A0A5K4F0K9_SCHMA Loading...

C2H2-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F0K9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 417 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.2	Very low	68.5	Low	239 Å²	239	96.7 Å²	96.7	100%	1.177	52%	0.518	S	S	*	.				0	148.1	0	-64.8	177.5	177.2	0	0	107.9
2	N	56.7	Low	69.3	Low	156 Å²	156	98.4 Å²	98.4	83%	0.834	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-75	136.6	172.2	-84.5	-28.4	0	0	0	109.7
3	P	60.9	Low	69.8	Low	85 Å²	85	95.6 Å²	95.6	55%	0.552	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-68.9	152.2	176.1	29.4	-34.8	0	0	0	111.2	R5	P3-R5 PolarHBondContact O-N 3.09Å
4	P	62.8	Low	70.5	Confident	92 Å²	92	99.8 Å²	99.8	60%	0.597	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-62.3	125.4	174.6	26.7	-33.6	0	0	0	110	F6	P4-F6 HydrophobicContact CB-CE2 3.98Å; P4-F6 HydrophobicContact CB-CZ 4.15Å; P4-F6 HydrophobicContact CG-CE2 3.96Å; P4-F6 HydrophobicContact CG-CZ 4.19Å; P4-F6 WeakPolarHBondContact O-CD2 3.13Å; P4-F6 WeakPolarHBondContact O-CE2 3.37Å
5	R	72.3	Confident	71.5	Confident	180 Å²	180	93.6 Å²	93.6	68%	0.679	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-99.9	127.9	173.2	-61.9	-175.7	179.5	-179.5	-0.8	109.3	P3 W14 C15	P3-R5 PolarHBondContact O-N 3.09Å; R5-W14 HydrophobicContact CB-CE3 3.63Å; R5-W14 HydrophobicContact CB-CZ3 4.02Å; R5-C15 WeakPolarHBondContact CA-O 3.5Å
6	F	80.6	Confident	72.3	Confident	55 Å²	55	94.1 Å²	94.1	24%	0.241	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	151.4	-179.1	-59.5	-98.3	0	0	0	108.9	P4 W14 C15 E18 L21	P4-F6 HydrophobicContact CB-CE2 3.98Å; P4-F6 HydrophobicContact CB-CZ 4.15Å; P4-F6 HydrophobicContact CG-CE2 3.96Å; P4-F6 HydrophobicContact CG-CZ 4.19Å; P4-F6 WeakPolarHBondContact O-CD2 3.13Å; P4-F6 WeakPolarHBondContact O-CE2 3.37Å; F6-W14 CarbonylContact O-C 3.52Å; F6-W14 VanDerWaalsContact O-CA 3.29Å; F6-W14 WeakPolarHBondContact O-CA 3.34Å; F6-C15 HydrophobicContact CB-CB 4.3Å; F6-C15 PolarHBondContact N-O 3.23Å; F6-C15 PolarHBondContact O-N 3.35Å; F6-E18 HydrophobicContact CD1-CB 3.79Å; F6-E18 HydrophobicContact CD1-CG 3.78Å; F6-E18 VanDerWaalsContact CD2-N 3.34Å; F6-E18 HydrophobicContact CE1-CB 3.51Å; F6-E18 HydrophobicContact CE1-CG 3.72Å; F6-E18 HydrophobicContact CE2-CB 4.3Å; F6-E18 VanDerWaalsContact CE2-N 3.33Å; F6-E18 HydrophobicContact CG-CB 4.31Å; F6-E18 HydrophobicContact CZ-CB 3.79Å; F6-E18 HydrophobicContact CZ-CG 4.49Å; F6-L21 HydrophobicContact CB-CB 4.1Å; F6-L21 HydrophobicContact CB-CD2 3.93Å
7	L	78.7	Confident	73.1	Confident	68 Å²	68	92.2 Å²	92.2	36%	0.356	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	122.1	-173.5	179	59.7	0	0	0	111.9	S9 W14	L7-S9 PolarHBondContact O-N 3.44Å; L7-W14 HydrophobicContact CB-CD2 4.28Å; L7-W14 HydrophobicContact CB-CE3 3.89Å; L7-W14 HydrophobicContact CB-CH2 4.26Å; L7-W14 HydrophobicContact CB-CZ3 3.89Å; L7-W14 HydrophobicContact CD1-CD2 3.91Å; L7-W14 HydrophobicContact CD1-CE3 4.39Å; L7-W14 HydrophobicContact CD1-CG 4.11Å; L7-W14 HydrophobicContact CD1-CZ2 4.39Å; L7-W14 HydrophobicContact CD2-CH2 4.01Å; L7-W14 HydrophobicContact CD2-CZ2 3.84Å; L7-W14 HydrophobicContact CD2-CZ3 4.48Å
8	C	81.9	Confident	73.7	Confident	1 Å²	1	91.9 Å²	91.9	1%	0.007	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	114.7	167.7	175	0	0	0	0	110.2	V10 C11 N12 V13 L21 H24 H30	C8-V10 PolarHBondContact O-N 3.18Å; C8-C11 HydrophobicContact CB-CB 4.35Å; C8-C11 PolarHBondContact O-N 3.14Å; C8-C11 PolarHBondContact SG-N 2.7Å; C8-N12 WeakPolarHBondContact O-CA 3.29Å; C8-N12 PolarHBondContact O-N 2.83Å; C8-V13 PolarHBondContact N-O 3.23Å; C8-L21 HydrophobicContact CB-CD1 3.59Å; C8-H24 VanDerWaalsContact SG-CD2 3.53Å; C8-H24 PolarHBondContact SG-NE2 3.1Å; C8-H30 PolarHBondContact SG-CE1 3.44Å; C8-H30 PolarHBondContact SG-ND1 3.31Å
9	S	69.5	Low	74.4	Confident	110 Å²	110	92.9 Å²	92.9	77%	0.769	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-36.3	-179.5	55.3	0	0	0	0	113.7	L7	L7-S9 PolarHBondContact O-N 3.44Å
10	V	71	Confident	75	Confident	56 Å²	56	91.5 Å²	91.5	34%	0.339	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-32.7	-178.5	-176.7	0	0	0	0	112.5	C8 L37	C8-V10 PolarHBondContact O-N 3.18Å; V10-L37 HydrophobicContact CG1-CD1 3.79Å
11	C	75.1	Confident	75.5	Confident	22 Å²	22	88 Å²	88	15%	0.149	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-12.5	-176.7	-69	0	0	0	0	114.3	C8 V13 H24	C8-C11 HydrophobicContact CB-CB 4.35Å; C8-C11 PolarHBondContact O-N 3.14Å; C8-C11 PolarHBondContact SG-N 2.7Å; C11-V13 HydrophobicContact CB-CB 4.33Å; C11-V13 HydrophobicContact CB-CG2 3.92Å; C11-V13 PolarHBondContact O-N 2.8Å; C11-H24 VanDerWaalsContact CB-NE2 3.26Å; C11-H24 WeakPolarHBondContact CB-NE2 3.19Å; C11-H24 PolarHBondContact SG-NE2 3.13Å
12	N	77.6	Confident	77.3	Confident	117 Å²	117	83.3 Å²	83.3	63%	0.626	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	36.3	-168	-160.2	34.4	0	0	0	113.5	C8	C8-N12 WeakPolarHBondContact O-CA 3.29Å; C8-N12 PolarHBondContact O-N 2.83Å
13	V	76.6	Confident	78.7	Confident	62 Å²	62	80.9 Å²	80.9	38%	0.376	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	125.8	179.4	171.7	0	0	0	0	109.5	C8 C11	C8-V13 PolarHBondContact N-O 3.23Å; C11-V13 HydrophobicContact CB-CB 4.33Å; C11-V13 HydrophobicContact CB-CG2 3.92Å; C11-V13 PolarHBondContact O-N 2.8Å
14	W	79.8	Confident	79.9	Confident	154 Å²	154	79.1 Å²	79.1	58%	0.583	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	131.4	171.9	-67.2	92.7	0	0	0	110.9	R5 F6 L7	R5-W14 HydrophobicContact CB-CE3 3.63Å; R5-W14 HydrophobicContact CB-CZ3 4.02Å; F6-W14 CarbonylContact O-C 3.52Å; F6-W14 VanDerWaalsContact O-CA 3.29Å; F6-W14 WeakPolarHBondContact O-CA 3.34Å; L7-W14 HydrophobicContact CB-CD2 4.28Å; L7-W14 HydrophobicContact CB-CE3 3.89Å; L7-W14 HydrophobicContact CB-CH2 4.26Å; L7-W14 HydrophobicContact CB-CZ3 3.89Å; L7-W14 HydrophobicContact CD1-CD2 3.91Å; L7-W14 HydrophobicContact CD1-CE3 4.39Å; L7-W14 HydrophobicContact CD1-CG 4.11Å; L7-W14 HydrophobicContact CD1-CZ2 4.39Å; L7-W14 HydrophobicContact CD2-CH2 4.01Å; L7-W14 HydrophobicContact CD2-CZ2 3.84Å; L7-W14 HydrophobicContact CD2-CZ3 4.48Å
15	C	85.4	Confident	80.7	Confident	7 Å²	7	78.2 Å²	78.2	5%	0.047	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	144.7	174.6	-58.9	0	0	0	0	109.4	R5 F6 T17 V20 L21	R5-C15 WeakPolarHBondContact CA-O 3.5Å; F6-C15 HydrophobicContact CB-CB 4.3Å; F6-C15 PolarHBondContact N-O 3.23Å; F6-C15 PolarHBondContact O-N 3.35Å; C15-T17 VanDerWaalsContact C-N 3.33Å; C15-V20 HydrophobicContact CB-CB 4.15Å; C15-V20 HydrophobicContact CB-CG1 3.88Å; C15-L21 HydrophobicContact CB-CB 4.07Å
16	D	83.3	Confident	81	Confident	102 Å²	102	75 Å²	75	55%	0.545	39%	0.386	S	S	.	.	S	Bend	trans	-76.4	-20.6	178.8	58.1	-3.2	0	0	0	113.5	V20	D16-V20 WeakPolarHBondContact OD1-CG2 3.42Å
17	T	86.3	Confident	81	Confident	61 Å²	61	73.6 Å²	73.6	37%	0.374	39%	0.386	S	S	.	.	S	Bend	trans	-145.5	153.7	-178.4	59.7	0	0	0	0	110.5	C15 N19 V20 L21	C15-T17 VanDerWaalsContact C-N 3.33Å; T17-N19 PolarHBondContact O-N 3.13Å; T17-V20 PolarHBondContact O-N 3.5Å; T17-V20 WeakPolarHBondContact OG1-CB 3.23Å; T17-V20 VanDerWaalsContact OG1-CG2 3.25Å; T17-V20 WeakPolarHBondContact OG1-CG2 3.43Å; T17-V20 PolarHBondContact OG1-N 3.48Å; T17-L21 PolarHBondContact O-N 2.94Å; T17-L21 VanDerWaalsContact O-N 3.15Å
18	E	84.3	Confident	80.7	Confident	87 Å²	87	79.6 Å²	79.6	41%	0.407	41%	0.409	S	S	.	.	H	α-helix	trans	-63.7	-31.5	177.5	-155.8	-176.5	126.3	0	0	112.2	F6 V20 L21 R22	F6-E18 HydrophobicContact CD1-CB 3.79Å; F6-E18 HydrophobicContact CD1-CG 3.78Å; F6-E18 VanDerWaalsContact CD2-N 3.34Å; F6-E18 HydrophobicContact CE1-CB 3.51Å; F6-E18 HydrophobicContact CE1-CG 3.72Å; F6-E18 HydrophobicContact CE2-CB 4.3Å; F6-E18 VanDerWaalsContact CE2-N 3.33Å; F6-E18 HydrophobicContact CG-CB 4.31Å; F6-E18 HydrophobicContact CZ-CB 3.79Å; F6-E18 HydrophobicContact CZ-CG 4.49Å; E18-V20 VanDerWaalsContact C-N 3.33Å; E18-V20 PolarHBondContact O-N 3.19Å; E18-L21 WeakPolarHBondContact O-CB 3.45Å; E18-L21 PolarHBondContact O-N 3.47Å; E18-L21 VanDerWaalsContact O-N 3.16Å; E18-R22 WeakPolarHBondContact O-CG 3.35Å; E18-R22 PolarHBondContact O-N 2.69Å; E18-R22 IonicContact OE1-CZ 3.09Å; E18-R22 VanDerWaalsContact OE1-CZ 3.24Å; E18-R22 IonicContact OE1-NE 3.32Å; E18-R22 PolarHBondContact OE1-NE 2.79Å; E18-R22 VanDerWaalsContact OE1-NE 3.17Å; E18-R22 IonicContact OE1-NH2 3.41Å; E18-R22 PolarHBondContact OE1-NH2 3.38Å
19	N	87.4	Confident	80.4	Confident	112 Å²	112	88.4 Å²	88.4	60%	0.599	45%	0.448	S	S	*	.	H	α-helix	trans	-65.4	-38.2	177.1	-162.2	38.5	0	0	0	111.5	T17 L21 R22 L23	T17-N19 PolarHBondContact O-N 3.13Å; N19-L21 VanDerWaalsContact C-N 3.34Å; N19-R22 PolarHBondContact O-N 3.4Å; N19-L23 WeakPolarHBondContact O-CB 3.31Å; N19-L23 VanDerWaalsContact O-CG 3.25Å; N19-L23 WeakPolarHBondContact O-CG 3.42Å; N19-L23 PolarHBondContact O-N 3.03Å
20	V	85.1	Confident	80.9	Confident	63 Å²	63	84.3 Å²	84.3	38%	0.382	42%	0.416	S	S	.	.	H	α-helix	trans	-69.1	-31.8	173.2	172.6	0	0	0	0	111.5	C15 D16 T17 E18 H24	C15-V20 HydrophobicContact CB-CB 4.15Å; C15-V20 HydrophobicContact CB-CG1 3.88Å; D16-V20 WeakPolarHBondContact OD1-CG2 3.42Å; T17-V20 PolarHBondContact O-N 3.5Å; T17-V20 WeakPolarHBondContact OG1-CB 3.23Å; T17-V20 VanDerWaalsContact OG1-CG2 3.25Å; T17-V20 WeakPolarHBondContact OG1-CG2 3.43Å; T17-V20 PolarHBondContact OG1-N 3.48Å; E18-V20 VanDerWaalsContact C-N 3.33Å; E18-V20 PolarHBondContact O-N 3.19Å; V20-H24 VanDerWaalsContact O-CB 3.27Å; V20-H24 WeakPolarHBondContact O-CB 3.21Å; V20-H24 PolarHBondContact O-N 3.36Å
21	L	86.2	Confident	80.9	Confident	20 Å²	20	88 Å²	88	11%	0.105	42%	0.424	C	S	.	.	H	α-helix	trans	-64.4	-50.4	170.7	176.5	59.9	0	0	0	111.8	F6 C8 C15 T17 E18 N19 L23 H24 E25	F6-L21 HydrophobicContact CB-CB 4.1Å; F6-L21 HydrophobicContact CB-CD2 3.93Å; C8-L21 HydrophobicContact CB-CD1 3.59Å; C15-L21 HydrophobicContact CB-CB 4.07Å; T17-L21 PolarHBondContact O-N 2.94Å; T17-L21 VanDerWaalsContact O-N 3.15Å; E18-L21 WeakPolarHBondContact O-CB 3.45Å; E18-L21 PolarHBondContact O-N 3.47Å; E18-L21 VanDerWaalsContact O-N 3.16Å; N19-L21 VanDerWaalsContact C-N 3.34Å; L21-L23 VanDerWaalsContact C-N 3.33Å; L21-L23 PolarHBondContact O-N 2.9Å; L21-H24 WeakPolarHBondContact O-CA 3.29Å; L21-H24 VanDerWaalsContact O-CB 3.29Å; L21-H24 WeakPolarHBondContact O-CB 3.45Å; L21-H24 PolarHBondContact O-N 3.28Å; L21-E25 HydrophobicContact CD1-CG 4.12Å; L21-E25 WeakPolarHBondContact O-CG 3.5Å; L21-E25 PolarHBondContact O-N 3.22Å
22	R	81.8	Confident	80.6	Confident	140 Å²	140	90.2 Å²	90.2	53%	0.528	44%	0.44	S	S	.	.	H	α-helix	trans	-61.2	-41	178.6	-66.2	179	-172	-172.5	0.2	111.9	E18 N19 H24 E25 M26	E18-R22 WeakPolarHBondContact O-CG 3.35Å; E18-R22 PolarHBondContact O-N 2.69Å; E18-R22 IonicContact OE1-CZ 3.09Å; E18-R22 VanDerWaalsContact OE1-CZ 3.24Å; E18-R22 IonicContact OE1-NE 3.32Å; E18-R22 PolarHBondContact OE1-NE 2.79Å; E18-R22 VanDerWaalsContact OE1-NE 3.17Å; E18-R22 IonicContact OE1-NH2 3.41Å; E18-R22 PolarHBondContact OE1-NH2 3.38Å; N19-R22 PolarHBondContact O-N 3.4Å; R22-H24 VanDerWaalsContact C-N 3.32Å; R22-H24 PolarHBondContact O-N 3.25Å; R22-E25 PolarHBondContact O-N 3.48Å; R22-M26 WeakPolarHBondContact O-CB 3.39Å; R22-M26 VanDerWaalsContact O-CG 3.25Å; R22-M26 WeakPolarHBondContact O-CG 3.27Å; R22-M26 PolarHBondContact O-N 3.26Å
23	L	87.2	Confident	79.9	Confident	105 Å²	105	90 Å²	90	55%	0.55	43%	0.433	S	S	.	.	H	α-helix	trans	-65.4	-33.4	174	-71.3	170.4	0	0	0	112.7	N19 L21 G27	N19-L23 WeakPolarHBondContact O-CB 3.31Å; N19-L23 VanDerWaalsContact O-CG 3.25Å; N19-L23 WeakPolarHBondContact O-CG 3.42Å; N19-L23 PolarHBondContact O-N 3.03Å; L21-L23 VanDerWaalsContact C-N 3.33Å; L21-L23 PolarHBondContact O-N 2.9Å; L23-G27 PolarHBondContact O-N 3.34Å
24	H	85.3	Confident	78.9	Confident	47 Å²	47	88.6 Å²	88.6	22%	0.218	43%	0.426	C	S	.	.	H	α-helix	trans	-64.5	-48.3	171.8	171.1	102.9	0	0	0	111.5	C8 C11 V20 L21 R22 M26 G27 H30	C8-H24 VanDerWaalsContact SG-CD2 3.53Å; C8-H24 PolarHBondContact SG-NE2 3.1Å; C11-H24 VanDerWaalsContact CB-NE2 3.26Å; C11-H24 WeakPolarHBondContact CB-NE2 3.19Å; C11-H24 PolarHBondContact SG-NE2 3.13Å; V20-H24 VanDerWaalsContact O-CB 3.27Å; V20-H24 WeakPolarHBondContact O-CB 3.21Å; V20-H24 PolarHBondContact O-N 3.36Å; L21-H24 WeakPolarHBondContact O-CA 3.29Å; L21-H24 VanDerWaalsContact O-CB 3.29Å; L21-H24 WeakPolarHBondContact O-CB 3.45Å; L21-H24 PolarHBondContact O-N 3.28Å; R22-H24 VanDerWaalsContact C-N 3.32Å; R22-H24 PolarHBondContact O-N 3.25Å; H24-M26 VanDerWaalsContact C-N 3.35Å; H24-M26 PolarHBondContact O-N 3.31Å; H24-G27 WeakPolarHBondContact O-CA 3.47Å; H24-G27 PolarHBondContact O-N 2.64Å; H24-H30 AromaticContact CD2-ND1 3.67Å; H24-H30 AromaticContact NE2-ND1 3.57Å; H24-H30 WeakPolarHBondContact O-CB 3.32Å
25	E	79.1	Confident	77.6	Confident	73 Å²	73	86.6 Å²	86.6	34%	0.341	43%	0.426	S	S	.	.	H	α-helix	trans	-64.9	-36.9	-179.8	-68.3	167.6	159.8	0	0	112.2	L21 R22 G27 H30	L21-E25 HydrophobicContact CD1-CG 4.12Å; L21-E25 WeakPolarHBondContact O-CG 3.5Å; L21-E25 PolarHBondContact O-N 3.22Å; R22-E25 PolarHBondContact O-N 3.48Å; E25-G27 PolarHBondContact O-N 3.48Å; E25-H30 PolarHBondContact O-CD2 3.14Å
26	M	78.3	Confident	75.7	Confident	114 Å²	114	89.8 Å²	89.8	56%	0.562	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-12.7	171.2	-66.6	173.9	72.3	0	0	113.5	R22 H24 R31	R22-M26 WeakPolarHBondContact O-CB 3.39Å; R22-M26 VanDerWaalsContact O-CG 3.25Å; R22-M26 WeakPolarHBondContact O-CG 3.27Å; R22-M26 PolarHBondContact O-N 3.26Å; H24-M26 VanDerWaalsContact C-N 3.35Å; H24-M26 PolarHBondContact O-N 3.31Å; M26-R31 VanDerWaalsContact O-CZ 3.24Å; M26-R31 PolarHBondContact O-NE 3.42Å; M26-R31 PolarHBondContact O-NH1 3.38Å
27	G	80.1	Confident	74	Confident	24 Å²	24	88.9 Å²	88.9	25%	0.247	44%	0.44	C	S	.	.	S	Bend	trans	-70.8	141	-173.5	0	0	0	0	0	114.1	L23 H24 E25 K29 H30 R31	L23-G27 PolarHBondContact O-N 3.34Å; H24-G27 WeakPolarHBondContact O-CA 3.47Å; H24-G27 PolarHBondContact O-N 2.64Å; E25-G27 PolarHBondContact O-N 3.48Å; G27-K29 PolarHBondContact O-N 2.79Å; G27-K29 VanDerWaalsContact O-N 3.08Å; G27-H30 PolarHBondContact O-N 3.44Å; G27-R31 PolarHBondContact O-N 2.91Å
28	K	74.2	Confident	71.7	Confident	194 Å²	194	92 Å²	92	84%	0.843	45%	0.454	S	S	*	.	H	α-helix	trans	-52.7	-34	179.4	-66.1	-174.8	179.5	-177.9	0	113.5	S32	K28-S32 WeakPolarHBondContact O-CB 3.19Å; K28-S32 PolarHBondContact O-N 2.85Å
29	K	74.3	Confident	69.4	Low	187 Å²	187	91.5 Å²	91.5	81%	0.813	46%	0.46	S	S	*	.	H	α-helix	trans	-71.9	-38.4	177.3	-69.3	-173.6	178.5	-178.5	0	113.3	G27 K33	G27-K29 PolarHBondContact O-N 2.79Å; G27-K29 VanDerWaalsContact O-N 3.08Å; K29-K33 PolarHBondContact O-N 3.08Å; K29-K33 VanDerWaalsContact O-N 3.09Å
30	H	79.7	Confident	67.2	Low	24 Å²	24	91.8 Å²	91.8	11%	0.111	46%	0.461	C	S	.	.	H	α-helix	trans	-67.7	-52.5	173.8	175.3	102.7	0	0	0	109.8	C8 H24 E25 G27 S32 K33 C34	C8-H30 PolarHBondContact SG-CE1 3.44Å; C8-H30 PolarHBondContact SG-ND1 3.31Å; H24-H30 AromaticContact CD2-ND1 3.67Å; H24-H30 AromaticContact NE2-ND1 3.57Å; H24-H30 WeakPolarHBondContact O-CB 3.32Å; E25-H30 PolarHBondContact O-CD2 3.14Å; G27-H30 PolarHBondContact O-N 3.44Å; H30-S32 VanDerWaalsContact C-N 3.29Å; H30-S32 PolarHBondContact O-N 3.14Å; H30-K33 CarbonylContact O-C 3.52Å; H30-K33 WeakPolarHBondContact O-CA 3.46Å; H30-K33 WeakPolarHBondContact O-CB 3.46Å; H30-K33 PolarHBondContact O-N 2.91Å; H30-C34 PolarHBondContact O-N 3.36Å; H30-C34 PolarHBondContact O-SG 3.34Å; H30-C34 VanDerWaalsContact O-SG 3.35Å
31	R	71.4	Confident	65	Low	134 Å²	134	92.7 Å²	92.7	51%	0.506	46%	0.464	S	S	.	.	H	α-helix	trans	-56.5	-39.9	177.9	-67.7	179	175.4	173.2	-1.4	112.9	M26 G27 C34 L35	M26-R31 VanDerWaalsContact O-CZ 3.24Å; M26-R31 PolarHBondContact O-NE 3.42Å; M26-R31 PolarHBondContact O-NH1 3.38Å; G27-R31 PolarHBondContact O-N 2.91Å; R31-C34 PolarHBondContact O-N 2.92Å; R31-L35 WeakPolarHBondContact O-CB 3.14Å; R31-L35 VanDerWaalsContact O-CG 3.27Å; R31-L35 WeakPolarHBondContact O-CG 3.4Å; R31-L35 PolarHBondContact O-N 3.1Å
32	S	69.7	Low	62.3	Low	67 Å²	67	97 Å²	97	47%	0.469	49%	0.491	S	S	.	.	H	α-helix	trans	-67.4	-36.2	173.8	-177.7	0	0	0	0	112.8	K28 H30 L35 V36	K28-S32 WeakPolarHBondContact O-CB 3.19Å; K28-S32 PolarHBondContact O-N 2.85Å; H30-S32 VanDerWaalsContact C-N 3.29Å; H30-S32 PolarHBondContact O-N 3.14Å; S32-L35 PolarHBondContact O-N 3.15Å; S32-V36 WeakPolarHBondContact O-CB 3.4Å; S32-V36 VanDerWaalsContact O-CG2 3.29Å; S32-V36 WeakPolarHBondContact O-CG2 3.28Å; S32-V36 PolarHBondContact O-N 3.15Å
33	K	62.2	Low	59.8	Low	114 Å²	114	101.6 Å²	101.6	50%	0.496	51%	0.508	S	S	.	.	H	α-helix	trans	-64.3	-41.4	170.9	-87.4	-169.8	168.1	-166.2	0	112.6	K29 H30 V36 L37	K29-K33 PolarHBondContact O-N 3.08Å; K29-K33 VanDerWaalsContact O-N 3.09Å; H30-K33 CarbonylContact O-C 3.52Å; H30-K33 WeakPolarHBondContact O-CA 3.46Å; H30-K33 WeakPolarHBondContact O-CB 3.46Å; H30-K33 PolarHBondContact O-N 2.91Å; K33-V36 PolarHBondContact O-N 2.94Å; K33-L37 WeakPolarHBondContact O-CB 3.49Å; K33-L37 WeakPolarHBondContact O-CD1 3.21Å; K33-L37 VanDerWaalsContact O-CG 3.29Å; K33-L37 WeakPolarHBondContact O-CG 3.43Å; K33-L37 PolarHBondContact O-N 3.4Å
34	C	55.2	Low	57.2	Low	32 Å²	32	102.3 Å²	102.3	22%	0.216	51%	0.513	C	S	.	.	H	α-helix	trans	-59.1	-54.3	172.1	-56.1	0	0	0	0	110.1	H30 R31 V36 L37 D38	H30-C34 PolarHBondContact O-N 3.36Å; H30-C34 PolarHBondContact O-SG 3.34Å; H30-C34 VanDerWaalsContact O-SG 3.35Å; R31-C34 PolarHBondContact O-N 2.92Å; C34-V36 PolarHBondContact O-N 2.88Å; C34-V36 VanDerWaalsContact O-N 3.14Å; C34-L37 CarbonylContact O-C 3.48Å; C34-L37 WeakPolarHBondContact O-CA 3.38Å; C34-L37 WeakPolarHBondContact O-CB 3.39Å; C34-L37 PolarHBondContact O-N 3.1Å; C34-D38 VanDerWaalsContact C-OD2 3.26Å; C34-D38 WeakPolarHBondContact O-CB 3.5Å; C34-D38 PolarHBondContact O-N 2.85Å
35	L	53.2	Low	54.7	Low	112 Å²	112	104.5 Å²	104.5	59%	0.586	52%	0.523	S	S	*	.	H	α-helix	trans	-61.2	-27.9	-179	-69	167.9	0	0	0	114.1	R31 S32 S39	R31-L35 WeakPolarHBondContact O-CB 3.14Å; R31-L35 VanDerWaalsContact O-CG 3.27Å; R31-L35 WeakPolarHBondContact O-CG 3.4Å; R31-L35 PolarHBondContact O-N 3.1Å; S32-L35 PolarHBondContact O-N 3.15Å; L35-S39 WeakPolarHBondContact O-CB 3.22Å; L35-S39 PolarHBondContact O-N 3.19Å; L35-S39 PolarHBondContact O-OG 2.7Å
36	V	46.2	Very low	52.8	Low	74 Å²	74	105.4 Å²	105.4	45%	0.448	53%	0.529	S	S	.	.	H	α-helix	trans	-78	-37	171.9	170.4	0	0	0	0	111.7	S32 K33 C34 D38 S39 L40	S32-V36 WeakPolarHBondContact O-CB 3.4Å; S32-V36 VanDerWaalsContact O-CG2 3.29Å; S32-V36 WeakPolarHBondContact O-CG2 3.28Å; S32-V36 PolarHBondContact O-N 3.15Å; K33-V36 PolarHBondContact O-N 2.94Å; C34-V36 PolarHBondContact O-N 2.88Å; C34-V36 VanDerWaalsContact O-N 3.14Å; V36-D38 PolarHBondContact O-N 3.4Å; V36-S39 PolarHBondContact O-N 3.43Å; V36-L40 PolarHBondContact O-N 3.29Å
37	L	47.6	Very low	50.6	Low	82 Å²	82	105.2 Å²	105.2	43%	0.429	53%	0.531	S	S	.	.	H	α-helix	trans	-62.8	-33.4	168.4	-72.3	162.5	0	0	0	111.8	V10 K33 C34 S39	V10-L37 HydrophobicContact CG1-CD1 3.79Å; K33-L37 WeakPolarHBondContact O-CB 3.49Å; K33-L37 WeakPolarHBondContact O-CD1 3.21Å; K33-L37 VanDerWaalsContact O-CG 3.29Å; K33-L37 WeakPolarHBondContact O-CG 3.43Å; K33-L37 PolarHBondContact O-N 3.4Å; C34-L37 CarbonylContact O-C 3.48Å; C34-L37 WeakPolarHBondContact O-CA 3.38Å; C34-L37 WeakPolarHBondContact O-CB 3.39Å; C34-L37 PolarHBondContact O-N 3.1Å; L37-S39 VanDerWaalsContact C-N 3.3Å; L37-S39 PolarHBondContact O-N 3.09Å
38	D	38	Very low	48.5	Very low	126 Å²	126	108.1 Å²	108.1	67%	0.674	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-7.3	177.8	-59.5	-37.4	0	0	0	113.5	C34 V36	C34-D38 VanDerWaalsContact C-OD2 3.26Å; C34-D38 WeakPolarHBondContact O-CB 3.5Å; C34-D38 PolarHBondContact O-N 2.85Å; V36-D38 PolarHBondContact O-N 3.4Å
39	S	36.1	Very low	46.4	Very low	77 Å²	77	102.3 Å²	102.3	54%	0.538	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135	-20.9	-174.3	58.8	0	0	0	0	116.6	L35 V36 L37	L35-S39 WeakPolarHBondContact O-CB 3.22Å; L35-S39 PolarHBondContact O-N 3.19Å; L35-S39 PolarHBondContact O-OG 2.7Å; V36-S39 PolarHBondContact O-N 3.43Å; L37-S39 VanDerWaalsContact C-N 3.3Å; L37-S39 PolarHBondContact O-N 3.09Å
40	L	39.1	Very low	44.4	Very low	118 Å²	118	94.9 Å²	94.9	62%	0.618	49%	0.486	S	S	*	.			trans	-141.1	65.4	-175.5	-72.3	175.5	0	0	0	112.8	V36	V36-L40 PolarHBondContact O-N 3.29Å
41	N	39.5	Very low	42.3	Very low	83 Å²	83	101.1 Å²	101.1	44%	0.444	51%	0.512	S	S	.	.			trans	-122.3	31	152.4	-146.9	70	0	0	0	113.2	R43	N41-R43 PolarHBondContact O-N 2.77Å
42	T	30.3	Very low	40.7	Very low	111 Å²	111	96.6 Å²	96.6	68%	0.681	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	126.5	156.7	48.8	0	0	0	0	109.7
43	R	30	Very low	39	Very low	235 Å²	235	95.1 Å²	95.1	89%	0.887	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.4	30	175.3	-53.1	-178.2	169.1	-178.3	-3.6	119.3	N41	N41-R43 PolarHBondContact O-N 2.77Å
44	D	31.1	Very low	37.8	Very low	121 Å²	121	92.7 Å²	92.7	65%	0.647	48%	0.48	S	S	*	.			trans	-118.2	51.6	153.1	-89.6	-30.9	0	0	0	110.6
45	H	32.9	Very low	36.9	Very low	92 Å²	92	91.6 Å²	91.6	43%	0.426	47%	0.472	S	S	.	.			trans	-77.4	120.6	162.7	-87.9	-98.4	0	0	0	108.3	D47 Q356 H386 F387	H45-D47 PolarHBondContact O-N 3.44Å; H45-Q356 VanDerWaalsContact CA-OE1 3.31Å; H45-Q356 PolarHBondContact ND1-OE1 2.94Å; H45-Q356 VanDerWaalsContact ND1-OE1 3.16Å; H45-H386 AromaticContact NE2-CE1 3.71Å; H45-F387 AromaticContact CE1-CD1 3.54Å; H45-F387 AromaticContact CE1-CE1 3.28Å; H45-F387 WeakPolarHBondContact CE1-CE1 3.41Å; H45-F387 AromaticContact ND1-CD1 3.89Å; H45-F387 AromaticContact ND1-CE1 3.6Å
46	I	38.6	Very low	36.1	Very low	93 Å²	93	90.9 Å²	90.9	48%	0.477	47%	0.473	S	S	.	.			trans	-87.4	103.2	167.3	-39.4	-179.2	0	0	0	107.2	Y48	I46-Y48 HydrophobicContact CB-CD2 4.06Å; I46-Y48 HydrophobicContact CB-CE2 4Å; I46-Y48 HydrophobicContact CD1-CE2 4.47Å; I46-Y48 HydrophobicContact CG2-CD2 3.62Å; I46-Y48 HydrophobicContact CG2-CE1 4.24Å; I46-Y48 HydrophobicContact CG2-CE2 3.3Å; I46-Y48 HydrophobicContact CG2-CG 4.23Å; I46-Y48 PolarHBondContact O-N 3.41Å
47	D	33.1	Very low	35.5	Very low	110 Å²	110	93.8 Å²	93.8	59%	0.588	49%	0.485	S	S	*	.			trans	-79.8	61.5	-170.9	-144.1	45	0	0	0	111.2	H45 P49 N392	H45-D47 PolarHBondContact O-N 3.44Å; D47-P49 VanDerWaalsContact O-CD 3.26Å; D47-P49 WeakPolarHBondContact O-CD 3.22Å; D47-N392 VanDerWaalsContact OD1-CG 3.29Å; D47-N392 PolarHBondContact OD1-ND2 3.19Å
48	Y	36.3	Very low	34.8	Very low	85 Å²	85	92.7 Å²	92.7	33%	0.333	48%	0.481	S	S	.	.			trans	-79.8	115.6	176.1	-73.3	-57.5	0	0	0	110.9	I46 L50 S280 S282	I46-Y48 HydrophobicContact CB-CD2 4.06Å; I46-Y48 HydrophobicContact CB-CE2 4Å; I46-Y48 HydrophobicContact CD1-CE2 4.47Å; I46-Y48 HydrophobicContact CG2-CD2 3.62Å; I46-Y48 HydrophobicContact CG2-CE1 4.24Å; I46-Y48 HydrophobicContact CG2-CE2 3.3Å; I46-Y48 HydrophobicContact CG2-CG 4.23Å; I46-Y48 PolarHBondContact O-N 3.41Å; Y48-L50 PolarHBondContact O-N 3.06Å; Y48-S280 PolarHBondContact OH-OG 3.39Å; Y48-S282 PolarHBondContact OH-OG 2.97Å
49	P	30.2	Very low	34.3	Very low	71 Å²	71	88.7 Å²	88.7	46%	0.461	46%	0.462	S	S	.	.			trans	-77.3	103.9	174.1	30.6	-34.1	0	0	0	111	D47 K51	D47-P49 VanDerWaalsContact O-CD 3.26Å; D47-P49 WeakPolarHBondContact O-CD 3.22Å; P49-K51 VanDerWaalsContact C-N 3.26Å; P49-K51 PolarHBondContact O-N 3.5Å
50	L	32.5	Very low	34	Very low	32 Å²	32	90.5 Å²	90.5	17%	0.168	47%	0.472	C	S	.	.			trans	-65	78.9	173.3	-70.1	166.8	0	0	0	111.7	Y48 I52 N270 C360 A391 R393	Y48-L50 PolarHBondContact O-N 3.06Å; L50-I52 PolarHBondContact O-N 2.87Å; L50-N270 WeakPolarHBondContact CD2-OD1 3.32Å; L50-C360 HydrophobicContact CD2-CB 4.12Å; L50-A391 WeakPolarHBondContact CB-O 3.35Å; L50-A391 VanDerWaalsContact CG-O 3.26Å; L50-A391 WeakPolarHBondContact CG-O 3.47Å; L50-A391 PolarHBondContact N-O 2.99Å; L50-R393 WeakPolarHBondContact CD1-O 3.46Å
51	K	35.2	Very low	33.7	Very low	154 Å²	154	91.7 Å²	91.7	67%	0.67	48%	0.479	S	S	*	.			trans	-69.4	85.2	163.8	-65.7	-175.7	179.1	175.4	0	109.3	P49 S53 L273	P49-K51 VanDerWaalsContact C-N 3.26Å; P49-K51 PolarHBondContact O-N 3.5Å; K51-S53 PolarHBondContact O-N 3.32Å; K51-L273 HydrophobicContact CB-CD1 4.28Å; K51-L273 HydrophobicContact CB-CD2 4.17Å; K51-L273 HydrophobicContact CD-CD2 4.46Å; K51-L273 HydrophobicContact CG-CD2 4.45Å
52	I	37.3	Very low	33	Very low	40 Å²	40	92.3 Å²	92.3	21%	0.205	49%	0.49	C	S	.	.			trans	-50.5	115.8	167.3	-71.9	163	0	0	0	107.9	L50 L54 D242 L266 R395	L50-I52 PolarHBondContact O-N 2.87Å; I52-L54 VanDerWaalsContact C-N 3.28Å; I52-L54 PolarHBondContact O-N 3.01Å; I52-D242 HydrophobicContact CD1-CB 3.91Å; I52-L266 HydrophobicContact CG1-CD2 4.29Å; I52-R395 HydrophobicContact CD1-CB 4.48Å
53	S	34.7	Very low	32.7	Very low	36 Å²	36	90.5 Å²	90.5	25%	0.252	49%	0.493	S	S	.	.			trans	-69.8	93	169.6	-66.5	0	0	0	0	107.3	K51 A269	K51-S53 PolarHBondContact O-N 3.32Å; S53-A269 VanDerWaalsContact N-CB 3.33Å; S53-A269 WeakPolarHBondContact OG-CA 3.43Å
54	L	37.5	Very low	32.6	Very low	62 Å²	62	83.9 Å²	83.9	33%	0.325	48%	0.482	S	S	.	.			trans	-42.2	126.5	167.5	-59.8	168.2	0	0	0	108.1	I52 T56 L57 A239	I52-L54 VanDerWaalsContact C-N 3.28Å; I52-L54 PolarHBondContact O-N 3.01Å; L54-T56 PolarHBondContact O-N 2.95Å; L54-L57 PolarHBondContact O-N 2.89Å; L54-A239 WeakPolarHBondContact CD2-O 3.36Å
55	P	36.3	Very low	32.5	Very low	9 Å²	9	83.4 Å²	83.4	6%	0.058	49%	0.486	C	S	.	.	G	3₁₀ helix	trans	-56.1	-17.8	177.5	-29.4	37.7	0	0	0	113.7	L57 V58 F210 S213 A239	P55-L57 PolarHBondContact O-N 3.04Å; P55-L57 VanDerWaalsContact O-N 3.14Å; P55-V58 PolarHBondContact O-N 3.33Å; P55-F210 HydrophobicContact CB-CE2 4.26Å; P55-S213 PolarHBondContact O-OG 3.38Å; P55-A239 VanDerWaalsContact CD-CB 3.45Å; P55-A239 HydrophobicContact CG-CB 3.6Å
56	T	35.3	Very low	32.4	Very low	97 Å²	97	90.1 Å²	90.1	60%	0.595	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-49	-26.7	164.5	-33.9	0	0	0	0	114.5	L54	L54-T56 PolarHBondContact O-N 2.95Å
57	L	33.9	Very low	31.8	Very low	136 Å²	136	92.5 Å²	92.5	71%	0.712	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-91.7	1.7	-177	-87.3	165.2	0	0	0	115.1	L54 P55	L54-L57 PolarHBondContact O-N 2.89Å; P55-L57 PolarHBondContact O-N 3.04Å; P55-L57 VanDerWaalsContact O-N 3.14Å
58	V	32.4	Very low	31.5	Very low	58 Å²	58	92.1 Å²	92.1	35%	0.352	53%	0.527	S	S	.	.			trans	-105.5	69.9	169.4	-169.7	0	0	0	0	109.8	P55 S213 V217	P55-V58 PolarHBondContact O-N 3.33Å; V58-S213 WeakPolarHBondContact O-CB 3.27Å; V58-S213 PolarHBondContact O-OG 3.45Å; V58-V217 HydrophobicContact CG2-CG2 4.5Å
59	T	28	Very low	31.1	Very low	42 Å²	42	95.2 Å²	95.2	26%	0.258	55%	0.549	S	S	.	.	S	Bend	trans	-143.5	127.7	160.3	74.7	0	0	0	0	110.9	D61 K209	T59-D61 PolarHBondContact O-N 3.35Å; T59-K209 HydrophobicContact CG2-CD 4.08Å; T59-K209 HydrophobicContact CG2-CG 4.35Å; T59-K209 PolarHBondContact OG1-NZ 3.02Å
60	P	29.1	Very low	31.3	Very low	116 Å²	116	99.4 Å²	99.4	75%	0.753	57%	0.567	S	S	*	*	S	Bend	trans	-60.4	132.4	162	-19.3	32.3	0	0	0	109.8
61	D	32.8	Very low	31	Very low	142 Å²	142	103.8 Å²	103.8	76%	0.759	59%	0.59	S	S	*	*			trans	37.3	125.9	-175.1	-96.6	-35.9	0	0	0	119.6	T59 K209	T59-D61 PolarHBondContact O-N 3.35Å; D61-K209 PolarHBondContact O-NZ 3.46Å; D61-K209 VanDerWaalsContact O-NZ 3.09Å
62	S	26	Very low	30.8	Very low	97 Å²	97	101.8 Å²	101.8	68%	0.678	59%	0.591	S	S	*	*			trans	-82.6	121.1	148.3	-71.6	0	0	0	0	106.9	S64	S62-S64 PolarHBondContact O-N 3.35Å
63	G	24.3	Very low	30.4	Very low	72 Å²	72	104.6 Å²	104.6	74%	0.742	61%	0.614	S	S	*	*			trans	-57.1	129.3	-174.6	0	0	0	0	0	112.2	P65	G63-P65 VanDerWaalsContact O-CD 3.24Å; G63-P65 WeakPolarHBondContact O-CD 3.42Å
64	S	27.4	Very low	30.1	Very low	96 Å²	96	107.9 Å²	107.9	67%	0.671	64%	0.637	S	S	*	*			trans	-92.3	108.1	172.2	-169.3	0	0	0	0	109.5	S62 R66	S62-S64 PolarHBondContact O-N 3.35Å; S64-R66 PolarHBondContact O-N 3.1Å
65	P	27.8	Very low	29.5	Very low	112 Å²	112	115.8 Å²	115.8	73%	0.727	66%	0.664	S	S	*	*			trans	-76	100.8	167.6	31	-31.5	0	0	0	108.5	G63	G63-P65 VanDerWaalsContact O-CD 3.24Å; G63-P65 WeakPolarHBondContact O-CD 3.42Å
66	R	31.5	Very low	29.1	Very low	232 Å²	232	120 Å²	120	88%	0.875	69%	0.694	S	S	*	*			trans	-99.7	90.9	164.9	-80.1	-167.4	169.1	-149.6	-3.3	109.3	S64	S64-R66 PolarHBondContact O-N 3.1Å
67	D	26.5	Very low	28.6	Very low	144 Å²	144	122.3 Å²	122.3	77%	0.77	71%	0.708	S	S	*	*			trans	-73.1	153.9	167.9	-93.2	-53.8	0	0	0	112.1
68	S	26.7	Very low	28.2	Very low	101 Å²	101	119.8 Å²	119.8	71%	0.706	72%	0.715	S	S	*	*			trans	73	134.5	158.7	71.9	0	0	0	0	120.4
69	L	28.5	Very low	27.9	Very low	150 Å²	150	123.6 Å²	123.6	79%	0.785	74%	0.738	S	S	*	*			trans	63.4	106.7	159.9	-58.8	148.4	0	0	0	114.7
70	L	34.1	Very low	28	Very low	160 Å²	160	128.4 Å²	128.4	84%	0.838	77%	0.767	S	S	*	*			cis	-148.5	167	38.8	-68.7	156.2	0	0	0	110.3
71	D	26.6	Very low	28	Very low	123 Å²	123	133 Å²	133	66%	0.658	77%	0.77	S	S	*	*			cis	-172.1	163.5	-33.8	-156.1	-40.8	0	0	0	106.7
72	T	29.5	Very low	27.7	Very low	112 Å²	112	133.1 Å²	133.1	69%	0.687	77%	0.77	S	S	*	*			trans	72.1	116.1	151	-63.6	0	0	0	0	120.9
73	S	29.6	Very low	27.8	Very low	99 Å²	99	134.3 Å²	134.3	69%	0.692	78%	0.778	S	S	*	*			trans	47	125	154.1	66.6	0	0	0	0	120.9
74	S	28.3	Very low	28	Very low	105 Å²	105	137.4 Å²	137.4	73%	0.734	78%	0.783	S	S	*	*			cis	103.3	120.4	28.6	75.4	0	0	0	0	115.7
75	Y	24.8	Very low	27.9	Very low	229 Å²	229	138 Å²	138	90%	0.898	79%	0.786	S	S	*	*			trans	77.8	148.8	154.4	-92.9	-93.7	0	0	0	122.9
76	S	27.6	Very low	27.8	Very low	97 Å²	97	138.3 Å²	138.3	68%	0.678	78%	0.781	S	S	*	*			trans	83	94.3	153.3	-59.8	0	0	0	0	122
77	T	24.3	Very low	27.7	Very low	146 Å²	146	134.9 Å²	134.9	90%	0.896	78%	0.776	S	S	*	*				21.9	126.9	129.2	53	0	0	0	0	121.2
78	G	27.1	Very low	27.8	Very low	82 Å²	82	137.9 Å²	137.9	85%	0.845	78%	0.782	S	S	*	*			trans	-161.6	135.9	158.2	0	0	0	0	0	112.4
79	T	24.5	Very low	27.7	Very low	139 Å²	139	138.5 Å²	138.5	85%	0.853	79%	0.786	S	S	*	*			trans	-123.6	136.5	-176.4	-54.2	0	0	0	0	110.2
80	V	31.1	Very low	27.7	Very low	143 Å²	143	137.6 Å²	137.6	87%	0.867	79%	0.789	S	S	*	*			trans	-164.3	149.3	144.4	132.9	0	0	0	0	113.6
81	R	28.8	Very low	27.2	Very low	213 Å²	213	137.8 Å²	137.8	80%	0.804	79%	0.79	S	S	*	*			trans	-56.4	149.1	-170.1	-68.3	160.2	166.2	167.9	-5.7	120
82	N	27.1	Very low	27.2	Very low	144 Å²	144	142.7 Å²	142.7	77%	0.77	80%	0.801	S	S	*	*				45.9	138.3	129.6	-52.9	12.9	0	0	0	122.7
83	S	28.6	Very low	26.9	Very low	121 Å²	121	141.2 Å²	141.2	85%	0.846	80%	0.795	S	S	*	*				-165	163.9	129	-85.1	0	0	0	0	113.5
84	T	26.6	Very low	26.7	Very low	137 Å²	137	143.7 Å²	143.7	84%	0.84	80%	0.801	S	S	*	*			trans	-155.6	152.1	-178.1	45.2	0	0	0	0	107.5
85	C	26.4	Very low	26.6	Very low	108 Å²	108	147.7 Å²	147.7	73%	0.73	81%	0.808	S	S	*	*			cis	-144.6	-149.9	4.7	37.4	0	0	0	0	107.6
86	D	26.5	Very low	26.7	Very low	119 Å²	119	145 Å²	145	64%	0.636	81%	0.808	S	S	*	*			cis	-162.7	-179.9	8.3	-142.6	-38.4	0	0	0	112.1
87	Q	27.5	Very low	26.5	Very low	161 Å²	161	145.2 Å²	145.2	75%	0.752	81%	0.81	S	S	*	*			trans	-7.4	134.2	163.4	-73.5	152.5	75	0	0	120
88	K	29.7	Very low	26.6	Very low	207 Å²	207	144.2 Å²	144.2	90%	0.9	81%	0.809	S	S	*	*				-159	140.8	123.2	-113.2	164.2	-172.8	173	0	113.1
89	S	24.6	Very low	26.5	Very low	114 Å²	114	144.9 Å²	144.9	80%	0.797	81%	0.806	S	S	*	*			trans	-141.2	155.4	165.4	-52.3	0	0	0	0	108.1
90	P	29	Very low	26.8	Very low	131 Å²	131	143.8 Å²	143.8	85%	0.851	80%	0.804	S	S	*	*			trans	-135.7	161.1	132.1	36.7	-26.2	0	0	0	113.1
91	L	21.9	Very low	26.8	Very low	163 Å²	163	146.1 Å²	146.1	85%	0.853	81%	0.806	S	S	*	*			trans	-87.3	149.3	178.8	-67	155.1	0	0	0	111.3
92	Y	28.6	Very low	27.4	Very low	226 Å²	226	140.2 Å²	140.2	89%	0.886	79%	0.789	S	S	*	*			trans	-141.8	145.6	136.5	-157.5	-101	0	0	0	109.4
93	S	23.2	Very low	28.6	Very low	82 Å²	82	136.7 Å²	136.7	57%	0.573	78%	0.776	S	S	*	*			trans	-149.6	127.8	-164.4	56.1	0	0	0	0	112.5
94	N	25	Very low	30.4	Very low	151 Å²	151	132.9 Å²	132.9	81%	0.807	74%	0.744	S	S	*	*			trans	176.1	134.2	153.7	-89.3	-15.8	0	0	0	104.9
95	E	25.2	Very low	32.2	Very low	188 Å²	188	129.3 Å²	129.3	88%	0.879	72%	0.72	S	S	*	*				-162.5	-179.3	57.8	-79.3	-162.7	136.3	0	0	112.9
96	L	28.3	Very low	34.2	Very low	172 Å²	172	124.4 Å²	124.4	90%	0.901	69%	0.687	S	S	*	*			trans	78.2	90.9	160.2	-153.2	64	0	0	0	118.7
97	S	23.2	Very low	36.2	Very low	103 Å²	103	126 Å²	126	72%	0.72	70%	0.695	S	S	*	*			trans	-52.4	167.2	168.4	-44.8	0	0	0	0	116.3
98	S	24.9	Very low	38	Very low	125 Å²	125	122.3 Å²	122.3	87%	0.874	68%	0.68	S	S	*	*			trans	67.5	71.4	161.2	57.8	0	0	0	0	118
99	A	26.1	Very low	40.2	Very low	96 Å²	96	113.5 Å²	113.5	79%	0.793	64%	0.644	S	S	*	*			trans	-125.8	136.4	148.3	0	0	0	0	0	108.7
100	S	29.9	Very low	42.7	Very low	115 Å²	115	111.4 Å²	111.4	80%	0.804	64%	0.641	S	S	*	*			trans	-65	134.6	-177.8	-53.7	0	0	0	0	111.6	I102	S100-I102 PolarHBondContact O-N 3.48Å
101	E	32.3	Very low	44.8	Very low	193 Å²	193	108.4 Å²	108.4	90%	0.902	62%	0.617	S	S	*	*			trans	-65	107.1	176.5	-68.8	-173.7	126.5	0	0	111	S103	E101-S103 VanDerWaalsContact C-N 3.25Å; E101-S103 PolarHBondContact O-N 2.94Å
102	I	40.8	Very low	47.2	Very low	88 Å²	88	106.4 Å²	106.4	45%	0.451	60%	0.603	S	S	.	*			trans	-73.1	83.1	174	-54.8	179.8	0	0	0	108.4	S100 F104	S100-I102 PolarHBondContact O-N 3.48Å; I102-F104 HydrophobicContact CB-CZ 4.2Å; I102-F104 HydrophobicContact CG2-CD1 4.22Å; I102-F104 HydrophobicContact CG2-CE1 3.61Å; I102-F104 HydrophobicContact CG2-CE2 4.48Å; I102-F104 HydrophobicContact CG2-CZ 3.76Å; I102-F104 VanDerWaalsContact O-CD2 3.31Å; I102-F104 WeakPolarHBondContact O-CD2 3.5Å; I102-F104 WeakPolarHBondContact O-CE2 3.28Å; I102-F104 PolarHBondContact O-N 3.32Å
103	S	51.5	Low	49.6	Very low	70 Å²	70	97 Å²	97	49%	0.49	57%	0.568	S	S	.	*			trans	-71.3	109.7	-179.2	72.3	0	0	0	0	111.1	E101 N105	E101-S103 VanDerWaalsContact C-N 3.25Å; E101-S103 PolarHBondContact O-N 2.94Å; S103-N105 WeakPolarHBondContact CB-OD1 3.25Å; S103-N105 PolarHBondContact O-N 2.67Å; S103-N105 PolarHBondContact OG-ND2 3.02Å
104	F	67.9	Low	51.8	Low	41 Å²	41	99.4 Å²	99.4	18%	0.18	57%	0.574	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.2	63	-178.6	-54.9	-76.6	0	0	0	111.7	I102 L113 S116 Y119	I102-F104 HydrophobicContact CB-CZ 4.2Å; I102-F104 HydrophobicContact CG2-CD1 4.22Å; I102-F104 HydrophobicContact CG2-CE1 3.61Å; I102-F104 HydrophobicContact CG2-CE2 4.48Å; I102-F104 HydrophobicContact CG2-CZ 3.76Å; I102-F104 VanDerWaalsContact O-CD2 3.31Å; I102-F104 WeakPolarHBondContact O-CD2 3.5Å; I102-F104 WeakPolarHBondContact O-CE2 3.28Å; I102-F104 PolarHBondContact O-N 3.32Å; F104-L113 HydrophobicContact CB-CB 4.19Å; F104-L113 WeakPolarHBondContact CB-O 3.42Å; F104-L113 PolarHBondContact O-N 3.18Å; F104-S116 VanDerWaalsContact CE1-CA 3.48Å; F104-Y119 HydrophobicContact CB-CD2 4.14Å; F104-Y119 HydrophobicContact CB-CG 4.15Å
105	N	64.1	Low	53.8	Low	63 Å²	63	93.8 Å²	93.8	34%	0.337	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	118.2	-167.6	-65.5	1.2	0	0	0	111.7	S103 N107 H112	S103-N105 WeakPolarHBondContact CB-OD1 3.25Å; S103-N105 PolarHBondContact O-N 2.67Å; S103-N105 PolarHBondContact OG-ND2 3.02Å; N105-N107 PolarHBondContact O-N 2.95Å; N105-H112 PolarHBondContact OD1-ND1 3.08Å
106	C	67.7	Low	55.3	Low	5 Å²	5	86.7 Å²	86.7	3%	0.034	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	91.2	171.6	-170.9	0	0	0	0	111.5	L108 C109 G110 I111 Y119 H122 H128	C106-L108 VanDerWaalsContact C-N 3.26Å; C106-L108 PolarHBondContact O-N 2.91Å; C106-C109 HydrophobicContact CB-CB 4.15Å; C106-C109 CarbonylContact O-C 3.6Å; C106-C109 PolarHBondContact O-N 2.95Å; C106-G110 PolarHBondContact O-N 3.01Å; C106-I111 HydrophobicContact CB-CG1 4.04Å; C106-I111 PolarHBondContact N-O 3.16Å; C106-I111 PolarHBondContact O-N 2.94Å; C106-Y119 HydrophobicContact CB-CE2 4.04Å; C106-H122 PolarHBondContact SG-NE2 2.77Å; C106-H128 PolarHBondContact SG-CE1 3.33Å; C106-H128 PolarHBondContact SG-ND1 3.13Å
107	N	68.9	Low	56.9	Low	153 Å²	153	84.5 Å²	84.5	82%	0.818	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-35.1	-179.8	-61.1	-11.1	0	0	0	113.1	N105 C109	N105-N107 PolarHBondContact O-N 2.95Å; N107-C109 VanDerWaalsContact C-N 3.3Å; N107-C109 PolarHBondContact O-N 3.09Å
108	L	65.6	Low	58.8	Low	83 Å²	83	84.2 Å²	84.2	44%	0.435	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-25.8	175.7	-69.5	176.9	0	0	0	113.7	C106 K131 I132	C106-L108 VanDerWaalsContact C-N 3.26Å; C106-L108 PolarHBondContact O-N 2.91Å; L108-K131 WeakPolarHBondContact O-CD 3.4Å; L108-I132 HydrophobicContact CD1-CG1 3.88Å
109	C	75.6	Confident	60.6	Low	21 Å²	21	81.3 Å²	81.3	14%	0.142	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-20	-178.8	-74.8	0	0	0	0	113.9	C106 N107 I111 H122 H128 K131	C106-C109 HydrophobicContact CB-CB 4.15Å; C106-C109 CarbonylContact O-C 3.6Å; C106-C109 PolarHBondContact O-N 2.95Å; N107-C109 VanDerWaalsContact C-N 3.3Å; N107-C109 PolarHBondContact O-N 3.09Å; C109-I111 HydrophobicContact CB-CD1 4.42Å; C109-I111 HydrophobicContact CB-CG1 4.05Å; C109-H122 PolarHBondContact SG-CE1 3.26Å; C109-H122 PolarHBondContact SG-NE2 2.94Å; C109-H122 VanDerWaalsContact SG-NE2 3.37Å; C109-H128 PolarHBondContact SG-ND1 2.97Å; C109-K131 PolarHBondContact O-NZ 2.86Å; C109-K131 VanDerWaalsContact O-NZ 3.16Å
110	G	77.5	Confident	62.4	Low	70 Å²	70	79 Å²	79	72%	0.722	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	30.2	-175.4	0	0	0	0	0	113.1	C106	C106-G110 PolarHBondContact O-N 3.01Å
111	I	72.1	Confident	64.1	Low	68 Å²	68	77.3 Å²	77.3	35%	0.349	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138.5	-176.9	67.1	174	0	0	0	112.2	C106 C109 L113 H122	C106-I111 HydrophobicContact CB-CG1 4.04Å; C106-I111 PolarHBondContact N-O 3.16Å; C106-I111 PolarHBondContact O-N 2.94Å; C109-I111 HydrophobicContact CB-CD1 4.42Å; C109-I111 HydrophobicContact CB-CG1 4.05Å; I111-L113 HydrophobicContact CD1-CD1 4.21Å; I111-L113 HydrophobicContact CD1-CD2 4.22Å; I111-L113 HydrophobicContact CD1-CG 4.28Å; I111-L113 HydrophobicContact CG1-CG 4.48Å; I111-H122 VanDerWaalsContact CD1-CE1 3.46Å; I111-H122 WeakPolarHBondContact CD1-CE1 3.39Å
112	H	71.7	Confident	66.1	Low	122 Å²	122	69.8 Å²	69.8	57%	0.565	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	147.6	164	-179.2	50.4	0	0	0	108.6	N105	N105-H112 PolarHBondContact OD1-ND1 3.08Å
113	L	79.2	Confident	67.1	Low	29 Å²	29	68.5 Å²	68.5	15%	0.152	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	157.4	179.5	-67.7	171.6	0	0	0	109.7	F104 I111 Q118 Y119 H122	F104-L113 HydrophobicContact CB-CB 4.19Å; F104-L113 WeakPolarHBondContact CB-O 3.42Å; F104-L113 PolarHBondContact O-N 3.18Å; I111-L113 HydrophobicContact CD1-CD1 4.21Å; I111-L113 HydrophobicContact CD1-CD2 4.22Å; I111-L113 HydrophobicContact CD1-CG 4.28Å; I111-L113 HydrophobicContact CG1-CG 4.48Å; L113-Q118 HydrophobicContact CB-CB 4.37Å; L113-Y119 HydrophobicContact CD1-CD2 4.28Å; L113-H122 HydrophobicContact CD1-CB 3.6Å
114	N	69.3	Low	68.1	Low	131 Å²	131	73.6 Å²	73.6	70%	0.701	39%	0.394	S	S	*	.	S	Bend	trans	-101.4	-1.6	-165.8	-60.6	14.8	0	0	0	113.3
115	S	68	Low	68.1	Low	34 Å²	34	72.8 Å²	72.8	24%	0.238	40%	0.397	C	S	.	.	S	Bend	trans	-155.3	160.8	173.3	81.1	0	0	0	0	113.7	D117 Q118 Y119	S115-D117 VanDerWaalsContact C-N 3.35Å; S115-D117 PolarHBondContact O-N 3.43Å; S115-Q118 PolarHBondContact O-N 3.09Å; S115-Q118 WeakPolarHBondContact OG-CG 3.44Å; S115-Q118 PolarHBondContact OG-N 2.86Å; S115-Y119 PolarHBondContact O-N 2.72Å
116	S	57.1	Low	68.2	Low	39 Å²	39	80.3 Å²	80.3	27%	0.273	42%	0.421	S	S	.	.	H	α-helix	trans	-57.2	-44.4	175.4	-169.2	0	0	0	0	112.2	F104 Q118 Y119 I120	F104-S116 VanDerWaalsContact CE1-CA 3.48Å; S116-Q118 VanDerWaalsContact C-N 3.34Å; S116-Q118 PolarHBondContact O-N 2.86Å; S116-Y119 WeakPolarHBondContact O-CB 3.45Å; S116-Y119 PolarHBondContact O-N 2.96Å; S116-Y119 VanDerWaalsContact O-N 3.11Å; S116-I120 WeakPolarHBondContact O-CB 3.29Å; S116-I120 WeakPolarHBondContact O-CG1 3.33Å; S116-I120 PolarHBondContact O-N 2.98Å
117	D	61.3	Low	68.3	Low	125 Å²	125	88.7 Å²	88.7	67%	0.668	46%	0.457	S	S	*	.	H	α-helix	trans	-64.5	-38.6	-179.5	-56.3	-68.8	0	0	0	112.4	S115 Y119 S121	S115-D117 VanDerWaalsContact C-N 3.35Å; S115-D117 PolarHBondContact O-N 3.43Å; D117-Y119 VanDerWaalsContact C-N 3.33Å; D117-S121 WeakPolarHBondContact O-CB 3.47Å; D117-S121 PolarHBondContact O-N 2.82Å
118	Q	63.4	Low	68.6	Low	97 Å²	97	82 Å²	82	45%	0.453	42%	0.42	S	S	.	.	H	α-helix	trans	-64	-40.8	173.7	-69	176.9	19.1	0	0	110.9	L113 S115 S116 H122	L113-Q118 HydrophobicContact CB-CB 4.37Å; S115-Q118 PolarHBondContact O-N 3.09Å; S115-Q118 WeakPolarHBondContact OG-CG 3.44Å; S115-Q118 PolarHBondContact OG-N 2.86Å; S116-Q118 VanDerWaalsContact C-N 3.34Å; S116-Q118 PolarHBondContact O-N 2.86Å; Q118-H122 VanDerWaalsContact O-CB 3.23Å; Q118-H122 WeakPolarHBondContact O-CB 3.38Å; Q118-H122 PolarHBondContact O-N 2.98Å
119	Y	63.4	Low	68.8	Low	65 Å²	65	82.5 Å²	82.5	26%	0.255	42%	0.42	S	S	.	.	H	α-helix	trans	-66.3	-48.4	177.2	-172.7	-108.3	0	0	0	112.6	F104 C106 L113 S115 S116 D117 S121 H122 L123	F104-Y119 HydrophobicContact CB-CD2 4.14Å; F104-Y119 HydrophobicContact CB-CG 4.15Å; C106-Y119 HydrophobicContact CB-CE2 4.04Å; L113-Y119 HydrophobicContact CD1-CD2 4.28Å; S115-Y119 PolarHBondContact O-N 2.72Å; S116-Y119 WeakPolarHBondContact O-CB 3.45Å; S116-Y119 PolarHBondContact O-N 2.96Å; S116-Y119 VanDerWaalsContact O-N 3.11Å; D117-Y119 VanDerWaalsContact C-N 3.33Å; Y119-S121 VanDerWaalsContact C-N 3.33Å; Y119-S121 PolarHBondContact O-N 2.87Å; Y119-H122 WeakPolarHBondContact O-CB 3.48Å; Y119-H122 PolarHBondContact O-N 2.9Å; Y119-H122 VanDerWaalsContact O-N 3.13Å; Y119-L123 HydrophobicContact CD1-CD1 4.13Å; Y119-L123 HydrophobicContact CD1-CG 4.5Å; Y119-L123 HydrophobicContact CE1-CD1 3.67Å; Y119-L123 HydrophobicContact CE1-CG 4.23Å; Y119-L123 HydrophobicContact CE2-CD2 4.46Å; Y119-L123 WeakPolarHBondContact O-CG 3.42Å; Y119-L123 PolarHBondContact O-N 2.89Å
120	I	61.9	Low	68.3	Low	46 Å²	46	84.3 Å²	84.3	24%	0.236	43%	0.433	C	S	.	.	H	α-helix	trans	-61.5	-42.3	176.3	-68.1	167.7	0	0	0	110.7	S116 L123 R124	S116-I120 WeakPolarHBondContact O-CB 3.29Å; S116-I120 WeakPolarHBondContact O-CG1 3.33Å; S116-I120 PolarHBondContact O-N 2.98Å; I120-L123 PolarHBondContact O-N 3.24Å; I120-R124 WeakPolarHBondContact O-CB 3.43Å; I120-R124 WeakPolarHBondContact O-CD 3.16Å; I120-R124 VanDerWaalsContact O-CG 3.23Å; I120-R124 WeakPolarHBondContact O-CG 3.29Å; I120-R124 PolarHBondContact O-N 3.04Å; I120-R124 VanDerWaalsContact O-N 3.1Å
121	S	67.2	Low	67.5	Low	80 Å²	80	85.4 Å²	85.4	56%	0.559	42%	0.418	S	S	*	.	H	α-helix	trans	-63.9	-39.1	174.1	-170.4	0	0	0	0	112	D117 Y119 R124 G125	D117-S121 WeakPolarHBondContact O-CB 3.47Å; D117-S121 PolarHBondContact O-N 2.82Å; Y119-S121 VanDerWaalsContact C-N 3.33Å; Y119-S121 PolarHBondContact O-N 2.87Å; S121-R124 CarbonylContact O-C 3.57Å; S121-R124 PolarHBondContact O-N 2.77Å; S121-G125 PolarHBondContact O-N 3.47Å
122	H	74.7	Confident	66.9	Low	35 Å²	35	85.4 Å²	85.4	16%	0.162	42%	0.418	C	S	.	.	H	α-helix	trans	-62.9	-47.5	174.7	171.2	71.2	0	0	0	112.8	C106 C109 I111 L113 Q118 Y119 R124 G125 H128	C106-H122 PolarHBondContact SG-NE2 2.77Å; C109-H122 PolarHBondContact SG-CE1 3.26Å; C109-H122 PolarHBondContact SG-NE2 2.94Å; C109-H122 VanDerWaalsContact SG-NE2 3.37Å; I111-H122 VanDerWaalsContact CD1-CE1 3.46Å; I111-H122 WeakPolarHBondContact CD1-CE1 3.39Å; L113-H122 HydrophobicContact CD1-CB 3.6Å; Q118-H122 VanDerWaalsContact O-CB 3.23Å; Q118-H122 WeakPolarHBondContact O-CB 3.38Å; Q118-H122 PolarHBondContact O-N 2.98Å; Y119-H122 WeakPolarHBondContact O-CB 3.48Å; Y119-H122 PolarHBondContact O-N 2.9Å; Y119-H122 VanDerWaalsContact O-N 3.13Å; H122-R124 VanDerWaalsContact C-N 3.27Å; H122-R124 PolarHBondContact O-N 3.14Å; H122-G125 WeakPolarHBondContact O-CA 3.44Å; H122-G125 PolarHBondContact O-N 2.88Å; H122-H128 AromaticContact CD2-ND1 3.6Å; H122-H128 AromaticContact CE1-ND1 3.84Å; H122-H128 AromaticContact NE2-CG 3.75Å; H122-H128 AromaticContact NE2-ND1 3Å; H122-H128 PolarHBondContact NE2-ND1 2.92Å; H122-H128 VanDerWaalsContact O-CB 3.23Å; H122-H128 WeakPolarHBondContact O-CB 3.32Å
123	L	60.4	Low	65.7	Low	62 Å²	62	83.8 Å²	83.8	33%	0.325	41%	0.413	S	S	.	.	H	α-helix	trans	-61	-36.3	176.6	-64.2	-177.6	0	0	0	111.9	Y119 I120 G125 H128	Y119-L123 HydrophobicContact CD1-CD1 4.13Å; Y119-L123 HydrophobicContact CD1-CG 4.5Å; Y119-L123 HydrophobicContact CE1-CD1 3.67Å; Y119-L123 HydrophobicContact CE1-CG 4.23Å; Y119-L123 HydrophobicContact CE2-CD2 4.46Å; Y119-L123 WeakPolarHBondContact O-CG 3.42Å; Y119-L123 PolarHBondContact O-N 2.89Å; I120-L123 PolarHBondContact O-N 3.24Å; L123-G125 PolarHBondContact O-N 3.45Å; L123-H128 WeakPolarHBondContact CD2-CE1 3.38Å; L123-H128 WeakPolarHBondContact CD2-NE2 3.32Å
124	R	72.2	Confident	64.1	Low	177 Å²	177	86.8 Å²	86.8	67%	0.668	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-11.4	172.4	-67.7	168.8	-177.3	180	3.3	113.1	I120 S121 H122 Q129	I120-R124 WeakPolarHBondContact O-CB 3.43Å; I120-R124 WeakPolarHBondContact O-CD 3.16Å; I120-R124 VanDerWaalsContact O-CG 3.23Å; I120-R124 WeakPolarHBondContact O-CG 3.29Å; I120-R124 PolarHBondContact O-N 3.04Å; I120-R124 VanDerWaalsContact O-N 3.1Å; S121-R124 CarbonylContact O-C 3.57Å; S121-R124 PolarHBondContact O-N 2.77Å; H122-R124 VanDerWaalsContact C-N 3.27Å; H122-R124 PolarHBondContact O-N 3.14Å; R124-Q129 PolarHBondContact O-NE2 3.29Å
125	G	68.3	Low	62.6	Low	24 Å²	24	85 Å²	85	25%	0.247	42%	0.423	C	S	.	.	S	Bend	trans	-76.2	136.4	-172.9	0	0	0	0	0	114.5	S121 H122 L123 K127 H128 Q129	S121-G125 PolarHBondContact O-N 3.47Å; H122-G125 WeakPolarHBondContact O-CA 3.44Å; H122-G125 PolarHBondContact O-N 2.88Å; L123-G125 PolarHBondContact O-N 3.45Å; G125-K127 PolarHBondContact O-N 3.33Å; G125-K127 VanDerWaalsContact O-N 3.1Å; G125-H128 WeakPolarHBondContact O-CB 3.35Å; G125-H128 PolarHBondContact O-N 3.45Å; G125-Q129 PolarHBondContact O-N 3.14Å; G125-Q129 VanDerWaalsContact O-N 3.08Å
126	R	65.7	Low	61.2	Low	221 Å²	221	86.1 Å²	86.1	83%	0.834	43%	0.431	S	S	*	.	H	α-helix	trans	-55.2	-33	-177.6	-165.7	-178.5	-68.4	166.5	-0.4	113.7	S130	R126-S130 PolarHBondContact O-N 3.16Å; R126-S130 PolarHBondContact O-OG 2.8Å
127	K	70.3	Confident	60.2	Low	181 Å²	181	88.8 Å²	88.8	79%	0.787	45%	0.446	S	S	*	.	H	α-helix	trans	-69.6	-38.6	176.4	-70.2	-173.8	179	-179.1	0	113.2	G125 S130 K131	G125-K127 PolarHBondContact O-N 3.33Å; G125-K127 VanDerWaalsContact O-N 3.1Å; K127-S130 WeakPolarHBondContact CA-OG 3.46Å; K127-S130 PolarHBondContact O-N 3.5Å; K127-S130 PolarHBondContact O-OG 3.19Å; K127-K131 PolarHBondContact O-N 2.85Å
128	H	76.5	Confident	58.8	Low	12 Å²	12	86.9 Å²	86.9	6%	0.056	44%	0.442	C	S	.	.	H	α-helix	trans	-66.8	-49	175.3	179.6	94.6	0	0	0	109.9	C106 C109 H122 L123 G125 S130 K131 I132	C106-H128 PolarHBondContact SG-CE1 3.33Å; C106-H128 PolarHBondContact SG-ND1 3.13Å; C109-H128 PolarHBondContact SG-ND1 2.97Å; H122-H128 AromaticContact CD2-ND1 3.6Å; H122-H128 AromaticContact CE1-ND1 3.84Å; H122-H128 AromaticContact NE2-CG 3.75Å; H122-H128 AromaticContact NE2-ND1 3Å; H122-H128 PolarHBondContact NE2-ND1 2.92Å; H122-H128 VanDerWaalsContact O-CB 3.23Å; H122-H128 WeakPolarHBondContact O-CB 3.32Å; L123-H128 WeakPolarHBondContact CD2-CE1 3.38Å; L123-H128 WeakPolarHBondContact CD2-NE2 3.32Å; G125-H128 WeakPolarHBondContact O-CB 3.35Å; G125-H128 PolarHBondContact O-N 3.45Å; H128-S130 VanDerWaalsContact C-N 3.27Å; H128-S130 PolarHBondContact O-N 2.76Å; H128-K131 PolarHBondContact O-N 2.96Å; H128-I132 WeakPolarHBondContact NE2-CD1 3.47Å; H128-I132 PolarHBondContact O-N 3.06Å; H128-I132 VanDerWaalsContact O-N 3.17Å
129	Q	69.2	Low	57.3	Low	94 Å²	94	86.8 Å²	86.8	44%	0.439	45%	0.452	S	S	.	.	H	α-helix	trans	-57.5	-36.7	175.9	-67.4	173.9	-0.4	0	0	112.8	R124 G125 N133	R124-Q129 PolarHBondContact O-NE2 3.29Å; G125-Q129 PolarHBondContact O-N 3.14Å; G125-Q129 VanDerWaalsContact O-N 3.08Å; Q129-N133 PolarHBondContact O-N 2.95Å; Q129-N133 PolarHBondContact O-ND2 2.87Å
130	S	65.4	Low	55.8	Low	59 Å²	59	90.9 Å²	90.9	41%	0.413	48%	0.478	S	S	.	.	H	α-helix	trans	-68.9	-32.5	173.3	53.5	0	0	0	0	114.1	R126 K127 H128 N133 V134	R126-S130 PolarHBondContact O-N 3.16Å; R126-S130 PolarHBondContact O-OG 2.8Å; K127-S130 WeakPolarHBondContact CA-OG 3.46Å; K127-S130 PolarHBondContact O-N 3.5Å; K127-S130 PolarHBondContact O-OG 3.19Å; H128-S130 VanDerWaalsContact C-N 3.27Å; H128-S130 PolarHBondContact O-N 2.76Å; S130-N133 PolarHBondContact O-N 2.73Å; S130-V134 WeakPolarHBondContact O-CG2 3.41Å; S130-V134 PolarHBondContact O-N 3.48Å
131	K	60.6	Low	54.1	Low	93 Å²	93	93.2 Å²	93.2	40%	0.404	50%	0.498	S	S	.	.	H	α-helix	trans	-70.1	-38.5	176.6	-82.7	-169	169.9	-169.6	0	112.2	L108 C109 K127 H128 N133 V134 N135	L108-K131 WeakPolarHBondContact O-CD 3.4Å; C109-K131 PolarHBondContact O-NZ 2.86Å; C109-K131 VanDerWaalsContact O-NZ 3.16Å; K127-K131 PolarHBondContact O-N 2.85Å; H128-K131 PolarHBondContact O-N 2.96Å; K131-N133 PolarHBondContact O-N 3.21Å; K131-V134 PolarHBondContact O-N 2.71Å; K131-N135 PolarHBondContact O-N 2.83Å; K131-N135 VanDerWaalsContact O-N 3.12Å
132	I	60	Low	52.2	Low	68 Å²	68	94.9 Å²	94.9	35%	0.349	51%	0.51	S	S	.	.	H	α-helix	trans	-53.6	-41.8	171.6	-66.6	167.7	0	0	0	111	L108 H128 V134 S136	L108-I132 HydrophobicContact CD1-CG1 3.88Å; H128-I132 WeakPolarHBondContact NE2-CD1 3.47Å; H128-I132 PolarHBondContact O-N 3.06Å; H128-I132 VanDerWaalsContact O-N 3.17Å; I132-V134 VanDerWaalsContact C-N 3.27Å; I132-V134 PolarHBondContact O-N 3.41Å; I132-S136 PolarHBondContact O-OG 3.31Å
133	N	45.2	Very low	49.9	Very low	87 Å²	87	98.4 Å²	98.4	47%	0.465	54%	0.539	S	S	.	.	H	α-helix	trans	-74.4	-9.2	-178.9	-65.7	-22.6	0	0	0	114.8	Q129 S130 K131	Q129-N133 PolarHBondContact O-N 2.95Å; Q129-N133 PolarHBondContact O-ND2 2.87Å; S130-N133 PolarHBondContact O-N 2.73Å; K131-N133 PolarHBondContact O-N 3.21Å
134	V	46.2	Very low	48.2	Very low	93 Å²	93	104.1 Å²	104.1	56%	0.564	57%	0.569	S	S	*	*	H	α-helix	trans	-107.1	-44.1	-178	174.4	0	0	0	0	111.7	S130 K131 I132 S136 V137	S130-V134 WeakPolarHBondContact O-CG2 3.41Å; S130-V134 PolarHBondContact O-N 3.48Å; K131-V134 PolarHBondContact O-N 2.71Å; I132-V134 VanDerWaalsContact C-N 3.27Å; I132-V134 PolarHBondContact O-N 3.41Å; V134-S136 PolarHBondContact O-N 3.07Å; V134-V137 PolarHBondContact O-N 3.09Å
135	N	38.7	Very low	45.9	Very low	93 Å²	93	101.5 Å²	101.5	50%	0.497	57%	0.573	S	S	.	*	H	α-helix	trans	-64.6	-12.1	-179.7	-81.8	34.9	0	0	0	114.1	K131 S138	K131-N135 PolarHBondContact O-N 2.83Å; K131-N135 VanDerWaalsContact O-N 3.12Å; N135-S138 PolarHBondContact O-OG 3.09Å
136	S	37.7	Very low	43.8	Very low	58 Å²	58	104.7 Å²	104.7	41%	0.406	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.9	-4.3	174.1	40.1	0	0	0	0	114	I132 V134	I132-S136 PolarHBondContact O-OG 3.31Å; V134-S136 PolarHBondContact O-N 3.07Å
137	V	36	Very low	41.9	Very low	95 Å²	95	103 Å²	103	58%	0.576	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	-23.8	-177.1	-169.6	0	0	0	0	112.1	V134 S139	V134-V137 PolarHBondContact O-N 3.09Å; V137-S139 PolarHBondContact O-N 3.15Å
138	S	31.8	Very low	39.6	Very low	85 Å²	85	99.1 Å²	99.1	59%	0.594	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-6.9	-176	42.4	0	0	0	0	115.8	N135	N135-S138 PolarHBondContact O-OG 3.09Å
139	S	31.8	Very low	37.2	Very low	95 Å²	95	104.2 Å²	104.2	66%	0.664	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	4.8	-176.7	-21.9	0	0	0	0	114.2	V137	V137-S139 PolarHBondContact O-N 3.15Å
140	L	32.5	Very low	35.2	Very low	150 Å²	150	104.3 Å²	104.3	79%	0.785	64%	0.642	S	S	*	*			trans	-108.5	26.4	-167.6	-83	159.2	0	0	0	114.4
141	S	26.9	Very low	33.5	Very low	96 Å²	96	107.2 Å²	107.2	67%	0.671	66%	0.662	S	S	*	*			trans	-93.2	121	168.1	54.8	0	0	0	0	111.1
142	S	25.9	Very low	32.3	Very low	114 Å²	114	110.5 Å²	110.5	80%	0.797	68%	0.684	S	S	*	*	S	Bend	trans	74.5	90.5	167.6	-49.6	0	0	0	0	117.9
143	S	26.6	Very low	31.2	Very low	110 Å²	110	112.1 Å²	112.1	77%	0.769	69%	0.69	S	S	*	*				174.6	125	126.3	-76.4	0	0	0	0	111.9	T145	S143-T145 PolarHBondContact O-N 2.81Å
144	D	24	Very low	31.2	Very low	182 Å²	182	112.9 Å²	112.9	97%	0.973	70%	0.695	S	S	*	*			trans	-86.3	85.6	170.1	-79	-63.4	0	0	0	110.8
145	T	24.9	Very low	31.3	Very low	121 Å²	121	113.8 Å²	113.8	74%	0.742	70%	0.702	S	S	*	*			trans	-132.5	148.3	173.1	-45.5	0	0	0	0	110.3	S143 M147	S143-T145 PolarHBondContact O-N 2.81Å; T145-M147 PolarHBondContact O-N 3.19Å
146	A	23.2	Very low	32	Very low	91 Å²	91	114.6 Å²	114.6	75%	0.752	71%	0.71	S	S	*	*			trans	-56	131.4	176.6	0	0	0	0	0	111.3	S148	A146-S148 VanDerWaalsContact C-N 3.34Å; A146-S148 PolarHBondContact O-N 3.33Å
147	M	26	Very low	33.1	Very low	186 Å²	186	114.6 Å²	114.6	92%	0.916	71%	0.711	S	S	*	*			trans	-81.5	77.7	-168.7	-167.5	128	63	0	0	112.2	T145	T145-M147 PolarHBondContact O-N 3.19Å
148	S	23.2	Very low	34.4	Very low	99 Å²	99	111.6 Å²	111.6	69%	0.692	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-55.1	145.8	160	-64.1	0	0	0	0	110.3	A146 S150	A146-S148 VanDerWaalsContact C-N 3.34Å; A146-S148 PolarHBondContact O-N 3.33Å; S148-S150 PolarHBondContact O-N 2.77Å
149	P	25.6	Very low	35.9	Very low	120 Å²	120	108.3 Å²	108.3	78%	0.779	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-64.8	126	177.4	27.1	-33.9	0	0	0	110.4	S151	P149-S151 PolarHBondContact O-N 2.97Å
150	S	26.8	Very low	37.7	Very low	95 Å²	95	105.2 Å²	105.2	66%	0.664	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-61.6	125.3	176.2	49.5	0	0	0	0	110.8	S148 D152	S148-S150 PolarHBondContact O-N 2.77Å; S150-D152 VanDerWaalsContact C-N 3.28Å; S150-D152 PolarHBondContact O-N 3.06Å
151	S	30.2	Very low	39.5	Very low	121 Å²	121	102 Å²	102	85%	0.846	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	56.4	-164.7	57.7	0	0	0	0	114.5	P149	P149-S151 PolarHBondContact O-N 2.97Å
152	D	35.7	Very low	41.9	Very low	162 Å²	162	97.4 Å²	97.4	87%	0.866	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.5	1.1	175.3	-96.6	-42.3	0	0	0	113.5	S150 N154	S150-D152 VanDerWaalsContact C-N 3.28Å; S150-D152 PolarHBondContact O-N 3.06Å; D152-N154 PolarHBondContact O-N 3.14Å
153	E	36.8	Very low	44.3	Very low	101 Å²	101	97.6 Å²	97.6	47%	0.472	58%	0.582	S	S	.	*			trans	-81.5	107.8	177.4	-70.9	-165.6	-175.9	0	0	111.9	P155 Y160 K174	E153-P155 WeakPolarHBondContact O-CD 3.4Å; E153-Y160 WeakPolarHBondContact OE1-CE2 3.25Å; E153-K174 IonicContact OE2-NZ 2.65Å; E153-K174 PolarHBondContact OE2-NZ 3.29Å
154	N	44.4	Very low	46.9	Very low	104 Å²	104	95.4 Å²	95.4	56%	0.556	56%	0.561	S	S	*	*			trans	-59.9	114.2	172.1	179.8	-7.4	0	0	0	110.4	D152 T156 S157	D152-N154 PolarHBondContact O-N 3.14Å; N154-T156 VanDerWaalsContact CG-OG1 3.25Å; N154-T156 PolarHBondContact ND2-OG1 3.47Å; N154-T156 PolarHBondContact O-N 3.11Å; N154-T156 PolarHBondContact OD1-N 3.37Å; N154-T156 PolarHBondContact OD1-OG1 2.96Å; N154-S157 PolarHBondContact O-N 3.47Å
155	P	49.2	Very low	49.3	Very low	111 Å²	111	87.1 Å²	87.1	72%	0.721	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-6.4	-171.2	29.1	-36.4	0	0	0	113.9	E153	E153-P155 WeakPolarHBondContact O-CD 3.4Å
156	T	52.7	Low	51.6	Low	110 Å²	110	83.6 Å²	83.6	68%	0.675	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-6.5	176.5	61	0	0	0	0	114.4	N154 V158	N154-T156 VanDerWaalsContact CG-OG1 3.25Å; N154-T156 PolarHBondContact ND2-OG1 3.47Å; N154-T156 PolarHBondContact O-N 3.11Å; N154-T156 PolarHBondContact OD1-N 3.37Å; N154-T156 PolarHBondContact OD1-OG1 2.96Å; T156-V158 PolarHBondContact O-N 3.33Å
157	S	61.2	Low	53.4	Low	59 Å²	59	79.7 Å²	79.7	41%	0.413	46%	0.459	S	S	.	.			trans	-65.5	128.4	176.7	-173.8	0	0	0	0	111.4	N154 F159 N171	N154-S157 PolarHBondContact O-N 3.47Å; S157-F159 WeakPolarHBondContact CB-O 3.45Å; S157-F159 PolarHBondContact O-N 2.92Å; S157-F159 PolarHBondContact OG-N 3.47Å; S157-F159 PolarHBondContact OG-O 3.05Å; S157-N171 WeakPolarHBondContact O-CB 3.38Å; S157-N171 PolarHBondContact O-ND2 2.93Å
158	V	63.8	Low	54.8	Low	31 Å²	31	72 Å²	72	19%	0.188	42%	0.422	C	S	.	.	S	Bend	trans	-67.8	-21.3	173.1	176.4	0	0	0	0	111.7	T156 F170 N171 S303	T156-V158 PolarHBondContact O-N 3.33Å; V158-F170 HydrophobicContact CG1-CD1 4.02Å; V158-F170 HydrophobicContact CG1-CE1 4.29Å; V158-F170 WeakPolarHBondContact O-CA 3.3Å; V158-N171 PolarHBondContact O-N 2.98Å; V158-S303 WeakPolarHBondContact CG2-OG 3.36Å
159	F	62.1	Low	56.8	Low	16 Å²	16	67.5 Å²	67.5	7%	0.07	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	146.4	-176.3	-66.8	-96.1	0	0	0	112.6	S157 V168 I169 F170 F305 I322	S157-F159 WeakPolarHBondContact CB-O 3.45Å; S157-F159 PolarHBondContact O-N 2.92Å; S157-F159 PolarHBondContact OG-N 3.47Å; S157-F159 PolarHBondContact OG-O 3.05Å; F159-V168 HydrophobicContact CB-CG1 3.86Å; F159-V168 HydrophobicContact CD1-CG1 4.18Å; F159-V168 WeakPolarHBondContact CD1-O 3.39Å; F159-V168 HydrophobicContact CG-CG1 4.31Å; F159-I169 CarbonylContact C-O 3.5Å; F159-I169 WeakPolarHBondContact CA-O 3.14Å; F159-I169 WeakPolarHBondContact CB-O 3.34Å; F159-I169 WeakPolarHBondContact CD1-O 3.25Å; F159-F170 HydrophobicContact CD1-CD1 4.14Å; F159-F170 HydrophobicContact CD1-CE1 4.26Å; F159-F170 HydrophobicContact CD1-CG 4.49Å; F159-F170 AromaticContact CE1-CD1 3.68Å; F159-F170 HydrophobicContact CE1-CD1 3.68Å; F159-F170 HydrophobicContact CE1-CD2 4.41Å; F159-F170 AromaticContact CE1-CE1 3.36Å; F159-F170 HydrophobicContact CE1-CE1 3.36Å; F159-F170 HydrophobicContact CE1-CE2 4.12Å; F159-F170 HydrophobicContact CE1-CG 4.2Å; F159-F170 AromaticContact CE1-CZ 3.59Å; F159-F170 HydrophobicContact CE1-CZ 3.59Å; F159-F170 HydrophobicContact CE2-CD1 4.31Å; F159-F170 AromaticContact CE2-CE1 3.93Å; F159-F170 HydrophobicContact CE2-CE1 3.93Å; F159-F170 AromaticContact CZ-CD1 3.79Å; F159-F170 HydrophobicContact CZ-CD1 3.79Å; F159-F170 AromaticContact CZ-CE1 3.16Å; F159-F170 HydrophobicContact CZ-CE1 3.16Å; F159-F170 AromaticContact CZ-CZ 3.63Å; F159-F170 HydrophobicContact CZ-CZ 3.63Å; F159-F305 AromaticContact CD2-CD2 3.46Å; F159-F305 HydrophobicContact CD2-CD2 3.46Å; F159-F305 VanDerWaalsContact CD2-CD2 3.46Å; F159-F305 AromaticContact CD2-CE2 3.37Å; F159-F305 HydrophobicContact CD2-CE2 3.37Å; F159-F305 HydrophobicContact CD2-CZ 4.44Å; F159-F305 AromaticContact CE2-CD2 3.15Å; F159-F305 HydrophobicContact CE2-CD2 3.15Å; F159-F305 AromaticContact CE2-CE2 3.46Å; F159-F305 HydrophobicContact CE2-CE2 3.46Å; F159-F305 VanDerWaalsContact CE2-CE2 3.46Å; F159-F305 AromaticContact CE2-CG 3.86Å; F159-F305 HydrophobicContact CE2-CG 3.86Å; F159-F305 HydrophobicContact CE2-CZ 4.4Å; F159-F305 HydrophobicContact CG-CD2 4.5Å; F159-F305 HydrophobicContact CG-CE2 4.02Å; F159-F305 AromaticContact CZ-CD2 3.99Å; F159-F305 HydrophobicContact CZ-CD2 3.99Å; F159-F305 HydrophobicContact CZ-CE2 4.14Å; F159-F305 HydrophobicContact CZ-CG 4.38Å; F159-I322 HydrophobicContact CE2-CD1 4.4Å; F159-I322 HydrophobicContact CZ-CD1 4.4Å
160	Y	69.8	Low	58.6	Low	31 Å²	31	62.1 Å²	62.1	12%	0.122	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	125.6	173.2	167.7	-105.8	0	0	0	110.2	E153 C162 V168 I169 K174 L178	E153-Y160 WeakPolarHBondContact OE1-CE2 3.25Å; Y160-C162 HydrophobicContact CD1-CB 4.47Å; Y160-C162 HydrophobicContact CE1-CB 3.8Å; Y160-V168 CarbonylContact O-C 3.59Å; Y160-V168 WeakPolarHBondContact O-CA 3.41Å; Y160-I169 HydrophobicContact CD1-CD1 4Å; Y160-I169 HydrophobicContact CD1-CG1 3.96Å; Y160-I169 PolarHBondContact N-O 3.06Å; Y160-I169 PolarHBondContact O-N 2.92Å; Y160-K174 HydrophobicContact CD1-CB 4.11Å; Y160-K174 HydrophobicContact CD1-CD 4.24Å; Y160-K174 HydrophobicContact CD1-CG 3.69Å; Y160-K174 HydrophobicContact CD2-CD 3.68Å; Y160-K174 VanDerWaalsContact CD2-CE 3.47Å; Y160-K174 HydrophobicContact CD2-CG 4.06Å; Y160-K174 HydrophobicContact CE1-CG 4.01Å; Y160-K174 HydrophobicContact CE2-CD 4.13Å; Y160-K174 VanDerWaalsContact CE2-CE 3.46Å; Y160-K174 HydrophobicContact CE2-CG 4.39Å; Y160-K174 HydrophobicContact CG-CB 4.11Å; Y160-K174 HydrophobicContact CG-CD 3.75Å; Y160-K174 HydrophobicContact CG-CG 3.7Å; Y160-L178 HydrophobicContact CE1-CD2 4.24Å
161	H	70.3	Confident	60.5	Low	81 Å²	81	59.6 Å²	59.6	38%	0.375	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	103.7	176.3	-174.4	-71.6	0	0	0	110.6	N163 F167 V168	H161-N163 PolarHBondContact CE1-OD1 3.37Å; H161-N163 PolarHBondContact ND1-OD1 3.21Å; H161-N163 PolarHBondContact O-N 2.98Å; H161-F167 CarbonylContact C-O 3.55Å; H161-F167 WeakPolarHBondContact CA-O 3.39Å; H161-V168 VanDerWaalsContact CD2-CG2 3.44Å; H161-V168 WeakPolarHBondContact CD2-CG2 3.21Å
162	C	78.3	Confident	62	Low	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	107.4	172.3	-178.8	0	0	0	0	110.6	Y160 I164 C165 Q166 F167 H177 H183	Y160-C162 HydrophobicContact CD1-CB 4.47Å; Y160-C162 HydrophobicContact CE1-CB 3.8Å; C162-I164 VanDerWaalsContact C-N 3.28Å; C162-I164 PolarHBondContact O-N 3.45Å; C162-C165 PolarHBondContact SG-N 3.18Å; C162-Q166 WeakPolarHBondContact O-CA 3.46Å; C162-Q166 PolarHBondContact O-N 2.87Å; C162-F167 PolarHBondContact N-O 3.38Å; C162-F167 PolarHBondContact O-N 3.23Å; C162-H177 VanDerWaalsContact CB-NE2 3.3Å; C162-H177 WeakPolarHBondContact CB-NE2 3.49Å; C162-H177 PolarHBondContact SG-NE2 2.86Å; C162-H183 PolarHBondContact SG-CE1 3.13Å; C162-H183 PolarHBondContact SG-ND1 3.15Å
163	N	76	Confident	63.4	Low	119 Å²	119	49.5 Å²	49.5	64%	0.636	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-29.5	179	-64.7	-20.8	0	0	0	113.6	H161	H161-N163 PolarHBondContact CE1-OD1 3.37Å; H161-N163 PolarHBondContact ND1-OD1 3.21Å; H161-N163 PolarHBondContact O-N 2.98Å
164	I	80.4	Confident	65.3	Low	64 Å²	64	47 Å²	47	33%	0.328	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-46.5	-179.2	-75.1	151.4	0	0	0	112.1	C162 N186 V187 L190	C162-I164 VanDerWaalsContact C-N 3.28Å; C162-I164 PolarHBondContact O-N 3.45Å; I164-N186 HydrophobicContact CG2-CB 4Å; I164-V187 HydrophobicContact CD1-CG2 4.06Å; I164-V187 HydrophobicContact CG2-CG2 3.86Å; I164-L190 HydrophobicContact CB-CD1 4.16Å; I164-L190 HydrophobicContact CG1-CD1 4.02Å; I164-L190 HydrophobicContact CG2-CD1 3.85Å
165	C	74.8	Confident	66.9	Low	8 Å²	8	47.9 Å²	47.9	5%	0.054	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-19.7	178.5	-58.9	0	0	0	0	112.5	C162 F167 H177 N186	C162-C165 PolarHBondContact SG-N 3.18Å; C165-F167 HydrophobicContact CB-CB 4.32Å; C165-F167 HydrophobicContact CB-CD1 4.1Å; C165-F167 HydrophobicContact CB-CD2 3.45Å; C165-F167 VanDerWaalsContact CB-CD2 3.45Å; C165-F167 HydrophobicContact CB-CE1 4.27Å; C165-F167 HydrophobicContact CB-CE2 3.67Å; C165-F167 HydrophobicContact CB-CG 3.68Å; C165-F167 HydrophobicContact CB-CZ 4.08Å; C165-H177 VanDerWaalsContact SG-CE1 3.58Å; C165-N186 PolarHBondContact SG-ND2 3.32Å
166	Q	71.9	Confident	68.1	Low	47 Å²	47	47.5 Å²	47.5	22%	0.22	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	52.4	-163.5	-59.1	175.8	-16.7	0	0	111.5	C162	C162-Q166 WeakPolarHBondContact O-CA 3.46Å; C162-Q166 PolarHBondContact O-N 2.87Å
167	F	62.4	Low	69.4	Low	9 Å²	9	42.2 Å²	42.2	4%	0.039	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	151.7	173.9	-60.8	-19.5	0	0	0	109.7	H161 C162 C165 I169 H177 E182 K226 R257	H161-F167 CarbonylContact C-O 3.55Å; H161-F167 WeakPolarHBondContact CA-O 3.39Å; C162-F167 PolarHBondContact N-O 3.38Å; C162-F167 PolarHBondContact O-N 3.23Å; C165-F167 HydrophobicContact CB-CB 4.32Å; C165-F167 HydrophobicContact CB-CD1 4.1Å; C165-F167 HydrophobicContact CB-CD2 3.45Å; C165-F167 VanDerWaalsContact CB-CD2 3.45Å; C165-F167 HydrophobicContact CB-CE1 4.27Å; C165-F167 HydrophobicContact CB-CE2 3.67Å; C165-F167 HydrophobicContact CB-CG 3.68Å; C165-F167 HydrophobicContact CB-CZ 4.08Å; F167-I169 HydrophobicContact CB-CG2 4.41Å; F167-H177 AromaticContact CD2-CE1 3.8Å; F167-E182 HydrophobicContact CE2-CG 4.48Å; F167-K226 HydrophobicContact CE1-CB 4.14Å; F167-K226 HydrophobicContact CE1-CD 4.34Å; F167-K226 HydrophobicContact CE1-CG 4.42Å; F167-R257 VanDerWaalsContact CE2-NH1 3.34Å
168	V	55.9	Low	70.5	Confident	24 Å²	24	42.5 Å²	42.5	15%	0.145	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	72.8	-177.3	-172.8	0	0	0	0	109	F159 Y160 H161 Y222	F159-V168 HydrophobicContact CB-CG1 3.86Å; F159-V168 HydrophobicContact CD1-CG1 4.18Å; F159-V168 WeakPolarHBondContact CD1-O 3.39Å; F159-V168 HydrophobicContact CG-CG1 4.31Å; Y160-V168 CarbonylContact O-C 3.59Å; Y160-V168 WeakPolarHBondContact O-CA 3.41Å; H161-V168 VanDerWaalsContact CD2-CG2 3.44Å; H161-V168 WeakPolarHBondContact CD2-CG2 3.21Å; V168-Y222 HydrophobicContact CB-CD1 4.28Å; V168-Y222 HydrophobicContact CB-CE1 3.71Å; V168-Y222 HydrophobicContact CB-CE2 4.5Å; V168-Y222 HydrophobicContact CG2-CE1 4.23Å; V168-Y222 PolarHBondContact N-OH 3.3Å; V168-Y222 WeakPolarHBondContact O-CE2 3.45Å; V168-Y222 PolarHBondContact O-OH 3.28Å
169	I	63.4	Low	71.4	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.026	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	167.4	-174.9	55.4	165.5	0	0	0	110.9	F159 Y160 F167 H177	F159-I169 CarbonylContact C-O 3.5Å; F159-I169 WeakPolarHBondContact CA-O 3.14Å; F159-I169 WeakPolarHBondContact CB-O 3.34Å; F159-I169 WeakPolarHBondContact CD1-O 3.25Å; Y160-I169 HydrophobicContact CD1-CD1 4Å; Y160-I169 HydrophobicContact CD1-CG1 3.96Å; Y160-I169 PolarHBondContact N-O 3.06Å; Y160-I169 PolarHBondContact O-N 2.92Å; F167-I169 HydrophobicContact CB-CG2 4.41Å; I169-H177 HydrophobicContact CD1-CB 3.21Å
170	F	63.9	Low	72.1	Confident	6 Å²	6	47.7 Å²	47.7	3%	0.026	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	140.8	170.1	-67	-80.2	0	0	0	110.7	V158 F159 S172 M173 K174 I260 W289 I322 F339	V158-F170 HydrophobicContact CG1-CD1 4.02Å; V158-F170 HydrophobicContact CG1-CE1 4.29Å; V158-F170 WeakPolarHBondContact O-CA 3.3Å; F159-F170 HydrophobicContact CD1-CD1 4.14Å; F159-F170 HydrophobicContact CD1-CE1 4.26Å; F159-F170 HydrophobicContact CD1-CG 4.49Å; F159-F170 AromaticContact CE1-CD1 3.68Å; F159-F170 HydrophobicContact CE1-CD1 3.68Å; F159-F170 HydrophobicContact CE1-CD2 4.41Å; F159-F170 AromaticContact CE1-CE1 3.36Å; F159-F170 HydrophobicContact CE1-CE1 3.36Å; F159-F170 HydrophobicContact CE1-CE2 4.12Å; F159-F170 HydrophobicContact CE1-CG 4.2Å; F159-F170 AromaticContact CE1-CZ 3.59Å; F159-F170 HydrophobicContact CE1-CZ 3.59Å; F159-F170 HydrophobicContact CE2-CD1 4.31Å; F159-F170 AromaticContact CE2-CE1 3.93Å; F159-F170 HydrophobicContact CE2-CE1 3.93Å; F159-F170 AromaticContact CZ-CD1 3.79Å; F159-F170 HydrophobicContact CZ-CD1 3.79Å; F159-F170 AromaticContact CZ-CE1 3.16Å; F159-F170 HydrophobicContact CZ-CE1 3.16Å; F159-F170 AromaticContact CZ-CZ 3.63Å; F159-F170 HydrophobicContact CZ-CZ 3.63Å; F170-S172 VanDerWaalsContact C-N 3.31Å; F170-S172 PolarHBondContact O-N 3.37Å; F170-M173 HydrophobicContact CB-CB 4.43Å; F170-M173 HydrophobicContact CB-CG 3.91Å; F170-M173 HydrophobicContact CB-SD 3.86Å; F170-M173 HydrophobicContact CD2-SD 4.05Å; F170-M173 HydrophobicContact CG-SD 4.34Å; F170-M173 CarbonylContact O-C 3.56Å; F170-M173 WeakPolarHBondContact O-CA 3.06Å; F170-M173 WeakPolarHBondContact O-CB 3.26Å; F170-M173 PolarHBondContact O-N 2.85Å; F170-K174 PolarHBondContact O-N 3.11Å; F170-I260 HydrophobicContact CZ-CD1 4.31Å; F170-W289 HydrophobicContact CD2-CH2 4.34Å; F170-W289 AromaticContact CE2-CH2 3.66Å; F170-W289 HydrophobicContact CE2-CH2 3.66Å; F170-W289 AromaticContact CE2-CZ3 3.7Å; F170-W289 HydrophobicContact CE2-CZ3 3.7Å; F170-W289 HydrophobicContact CZ-CH2 4.48Å; F170-W289 HydrophobicContact CZ-CZ3 4.07Å; F170-I322 HydrophobicContact CE1-CD1 4.39Å; F170-F339 AromaticContact CD1-CE2 3.92Å; F170-F339 HydrophobicContact CD1-CE2 3.92Å; F170-F339 HydrophobicContact CD1-CZ 4.25Å; F170-F339 AromaticContact CE1-CE2 3.6Å; F170-F339 HydrophobicContact CE1-CE2 3.6Å; F170-F339 AromaticContact CE1-CZ 3.55Å; F170-F339 HydrophobicContact CE1-CZ 3.55Å; F170-F339 HydrophobicContact CE2-CZ 4.26Å; F170-F339 HydrophobicContact CZ-CE2 4.1Å; F170-F339 AromaticContact CZ-CZ 3.58Å; F170-F339 HydrophobicContact CZ-CZ 3.58Å
171	N	66.8	Low	72.5	Confident	42 Å²	42	50.8 Å²	50.8	23%	0.225	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-65.7	-34.6	-174.5	-169	21.6	0	0	0	111.9	S157 V158 M173 K174	S157-N171 WeakPolarHBondContact O-CB 3.38Å; S157-N171 PolarHBondContact O-ND2 2.93Å; V158-N171 PolarHBondContact O-N 2.98Å; N171-M173 PolarHBondContact O-N 3.44Å; N171-K174 WeakPolarHBondContact O-CB 3.43Å; N171-K174 PolarHBondContact O-N 3.11Å
172	S	62.2	Low	72.7	Confident	56 Å²	56	49 Å²	49	39%	0.392	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-62.4	-6.6	169.8	54.2	0	0	0	0	114.6	F170 E295	F170-S172 VanDerWaalsContact C-N 3.31Å; F170-S172 PolarHBondContact O-N 3.37Å; S172-E295 WeakPolarHBondContact CA-OE2 3.5Å; S172-E295 WeakPolarHBondContact CB-OE2 3.4Å
173	M	64.8	Low	72.9	Confident	15 Å²	15	49.5 Å²	49.5	7%	0.074	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-116.9	-1.4	-178.7	-47.4	-176.8	85.2	0	0	111.3	F170 N171 L175 K176 H177 F252 D256	F170-M173 HydrophobicContact CB-CB 4.43Å; F170-M173 HydrophobicContact CB-CG 3.91Å; F170-M173 HydrophobicContact CB-SD 3.86Å; F170-M173 HydrophobicContact CD2-SD 4.05Å; F170-M173 HydrophobicContact CG-SD 4.34Å; F170-M173 CarbonylContact O-C 3.56Å; F170-M173 WeakPolarHBondContact O-CA 3.06Å; F170-M173 WeakPolarHBondContact O-CB 3.26Å; F170-M173 PolarHBondContact O-N 2.85Å; N171-M173 PolarHBondContact O-N 3.44Å; M173-L175 PolarHBondContact O-N 3.27Å; M173-K176 PolarHBondContact O-N 3.22Å; M173-H177 PolarHBondContact O-N 2.78Å; M173-H177 VanDerWaalsContact O-N 3.17Å; M173-F252 HydrophobicContact CE-CE1 3.6Å; M173-F252 HydrophobicContact CE-CZ 3.49Å; M173-F252 VanDerWaalsContact CE-CZ 3.49Å; M173-D256 VanDerWaalsContact CE-CG 3.42Å; M173-D256 WeakPolarHBondContact CE-OD1 3.24Å; M173-D256 WeakPolarHBondContact CE-OD2 3.2Å
174	K	77.3	Confident	73.3	Confident	50 Å²	50	49.8 Å²	49.8	22%	0.217	24%	0.243	C	C	.	.	H	α-helix	trans	-47.6	-52.6	178.4	176.3	175.6	-175.1	177.2	0	113	E153 Y160 F170 N171 H177 L178	E153-K174 IonicContact OE2-NZ 2.65Å; E153-K174 PolarHBondContact OE2-NZ 3.29Å; Y160-K174 HydrophobicContact CD1-CB 4.11Å; Y160-K174 HydrophobicContact CD1-CD 4.24Å; Y160-K174 HydrophobicContact CD1-CG 3.69Å; Y160-K174 HydrophobicContact CD2-CD 3.68Å; Y160-K174 VanDerWaalsContact CD2-CE 3.47Å; Y160-K174 HydrophobicContact CD2-CG 4.06Å; Y160-K174 HydrophobicContact CE1-CG 4.01Å; Y160-K174 HydrophobicContact CE2-CD 4.13Å; Y160-K174 VanDerWaalsContact CE2-CE 3.46Å; Y160-K174 HydrophobicContact CE2-CG 4.39Å; Y160-K174 HydrophobicContact CG-CB 4.11Å; Y160-K174 HydrophobicContact CG-CD 3.75Å; Y160-K174 HydrophobicContact CG-CG 3.7Å; F170-K174 PolarHBondContact O-N 3.11Å; N171-K174 WeakPolarHBondContact O-CB 3.43Å; N171-K174 PolarHBondContact O-N 3.11Å; K174-H177 PolarHBondContact O-N 2.7Å; K174-L178 HydrophobicContact CG-CD1 4.09Å; K174-L178 WeakPolarHBondContact O-CG 3.4Å; K174-L178 PolarHBondContact O-N 3.23Å
175	L	77.9	Confident	73.5	Confident	122 Å²	122	50.9 Å²	50.9	64%	0.639	25%	0.25	S	C	*	.	H	α-helix	trans	-59.7	-52.5	-177.2	-73.3	162.8	0	0	0	111.7	M173 H177 L178 E179	M173-L175 PolarHBondContact O-N 3.27Å; L175-H177 VanDerWaalsContact C-N 3.26Å; L175-H177 PolarHBondContact O-N 3.25Å; L175-L178 PolarHBondContact O-N 3.01Å; L175-L178 VanDerWaalsContact O-N 3.08Å; L175-E179 WeakPolarHBondContact O-CG 3.29Å; L175-E179 PolarHBondContact O-N 3.42Å
176	K	74.4	Confident	73.7	Confident	102 Å²	102	51.9 Å²	51.9	44%	0.443	26%	0.255	S	S	.	.	H	α-helix	trans	-59.1	-35.4	-179.8	-71.6	-174	169.7	-170.5	0	113.4	M173 E179 S180 F252	M173-K176 PolarHBondContact O-N 3.22Å; K176-E179 PolarHBondContact O-N 2.92Å; K176-S180 PolarHBondContact O-N 2.93Å; K176-S180 VanDerWaalsContact O-N 3.09Å; K176-F252 HydrophobicContact CB-CD1 4Å; K176-F252 HydrophobicContact CB-CE1 3.85Å; K176-F252 HydrophobicContact CD-CD1 3.99Å; K176-F252 HydrophobicContact CD-CD2 4.41Å; K176-F252 HydrophobicContact CD-CE1 3.34Å; K176-F252 HydrophobicContact CD-CE2 3.83Å; K176-F252 HydrophobicContact CD-CG 4.49Å; K176-F252 HydrophobicContact CD-CZ 3.27Å; K176-F252 HydrophobicContact CG-CE1 4.27Å; K176-F252 VanDerWaalsContact NZ-CE2 3.33Å
177	H	80.8	Confident	74.3	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-69.9	-43.8	174.2	170.1	62.3	0	0	0	112.8	C162 C165 F167 I169 M173 K174 L175 E179 S180 H183 D253	C162-H177 VanDerWaalsContact CB-NE2 3.3Å; C162-H177 WeakPolarHBondContact CB-NE2 3.49Å; C162-H177 PolarHBondContact SG-NE2 2.86Å; C165-H177 VanDerWaalsContact SG-CE1 3.58Å; F167-H177 AromaticContact CD2-CE1 3.8Å; I169-H177 HydrophobicContact CD1-CB 3.21Å; M173-H177 PolarHBondContact O-N 2.78Å; M173-H177 VanDerWaalsContact O-N 3.17Å; K174-H177 PolarHBondContact O-N 2.7Å; L175-H177 VanDerWaalsContact C-N 3.26Å; L175-H177 PolarHBondContact O-N 3.25Å; H177-E179 PolarHBondContact O-N 3.34Å; H177-S180 WeakPolarHBondContact O-CB 3.45Å; H177-S180 PolarHBondContact O-N 2.99Å; H177-S180 PolarHBondContact O-OG 2.81Å; H177-H183 AromaticContact CD2-ND1 3.66Å; H177-H183 AromaticContact CE1-ND1 3.61Å; H177-H183 AromaticContact NE2-CG 3.99Å; H177-H183 AromaticContact NE2-ND1 3.06Å; H177-H183 PolarHBondContact NE2-ND1 2.87Å; H177-H183 WeakPolarHBondContact O-CB 3.29Å; H177-D253 WeakPolarHBondContact CA-OD1 3.35Å; H177-D253 IonicContact CE1-OD2 2.65Å; H177-D253 IonicContact CG-OD2 3.47Å; H177-D253 IonicContact ND1-OD1 3.8Å; H177-D253 IonicContact ND1-OD2 3.34Å; H177-D253 PolarHBondContact ND1-OD2 3.15Å
178	L	82.7	Confident	75.5	Confident	64 Å²	64	57.7 Å²	57.7	34%	0.335	28%	0.279	S	S	.	.	H	α-helix	trans	-61.7	-28.5	176	-65	175.1	0	0	0	111.7	Y160 K174 L175 H183	Y160-L178 HydrophobicContact CE1-CD2 4.24Å; K174-L178 HydrophobicContact CG-CD1 4.09Å; K174-L178 WeakPolarHBondContact O-CG 3.4Å; K174-L178 PolarHBondContact O-N 3.23Å; L175-L178 PolarHBondContact O-N 3.01Å; L175-L178 VanDerWaalsContact O-N 3.08Å; L178-H183 WeakPolarHBondContact CD2-CE1 3.26Å
179	E	82.3	Confident	76.7	Confident	136 Å²	136	63.9 Å²	63.9	64%	0.636	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-15.9	173.3	-68.2	166.2	178.3	0	0	114	L175 K176 H177	L175-E179 WeakPolarHBondContact O-CG 3.29Å; L175-E179 PolarHBondContact O-N 3.42Å; K176-E179 PolarHBondContact O-N 2.92Å; H177-E179 PolarHBondContact O-N 3.34Å
180	S	78.3	Confident	77.5	Confident	20 Å²	20	69 Å²	69	14%	0.14	33%	0.326	C	S	.	.	S	Bend	trans	-71.5	146.3	-168.2	96.5	0	0	0	0	113.4	K176 H177 E182 H183 R184 D253	K176-S180 PolarHBondContact O-N 2.93Å; K176-S180 VanDerWaalsContact O-N 3.09Å; H177-S180 WeakPolarHBondContact O-CB 3.45Å; H177-S180 PolarHBondContact O-N 2.99Å; H177-S180 PolarHBondContact O-OG 2.81Å; S180-E182 PolarHBondContact O-N 2.86Å; S180-E182 PolarHBondContact OG-N 2.82Å; S180-H183 PolarHBondContact O-N 3.27Å; S180-H183 VanDerWaalsContact O-N 3.11Å; S180-H183 PolarHBondContact OG-N 3Å; S180-H183 VanDerWaalsContact OG-N 3.13Å; S180-R184 VanDerWaalsContact O-CG 3.3Å; S180-R184 WeakPolarHBondContact O-CG 3.17Å; S180-R184 PolarHBondContact O-N 2.9Å; S180-D253 VanDerWaalsContact CB-OD2 3.24Å; S180-D253 WeakPolarHBondContact CB-OD2 3.37Å; S180-D253 PolarHBondContact OG-OD2 3.4Å
181	E	78.1	Confident	78	Confident	96 Å²	96	77.6 Å²	77.6	45%	0.449	36%	0.364	S	S	.	.	H	α-helix	trans	-59.7	-31.6	175.2	-82.3	-57.5	127.4	0	0	112.4	R184 L185 R188	E181-R184 PolarHBondContact O-N 2.75Å; E181-R184 WeakPolarHBondContact OE1-CD 3.25Å; E181-R184 IonicContact OE1-CZ 3.4Å; E181-R184 IonicContact OE1-NE 2.73Å; E181-R184 IonicContact OE1-NH1 2.7Å; E181-R184 PolarHBondContact OE1-NH1 2.82Å; E181-L185 VanDerWaalsContact O-CB 3.24Å; E181-L185 WeakPolarHBondContact O-CB 3.26Å; E181-L185 WeakPolarHBondContact O-CD1 3.36Å; E181-L185 WeakPolarHBondContact O-CG 3.28Å; E181-L185 PolarHBondContact O-N 3.31Å; E181-R188 IonicContact OE2-NH1 3.7Å
182	E	74.9	Confident	77.8	Confident	43 Å²	43	77.1 Å²	77.1	20%	0.201	37%	0.369	C	S	.	.	H	α-helix	trans	-65.6	-41.8	175.9	-171.2	170	-144	0	0	111.1	F167 S180 N186 R257	F167-E182 HydrophobicContact CE2-CG 4.48Å; S180-E182 PolarHBondContact O-N 2.86Å; S180-E182 PolarHBondContact OG-N 2.82Å; E182-N186 PolarHBondContact O-N 2.64Å; E182-N186 PolarHBondContact O-ND2 3.43Å; E182-N186 VanDerWaalsContact O-ND2 3.13Å; E182-R257 IonicContact OE1-NH2 2.7Å; E182-R257 PolarHBondContact OE1-NH2 3.24Å; E182-R257 IonicContact OE2-CZ 3.63Å; E182-R257 IonicContact OE2-NH1 3.6Å; E182-R257 PolarHBondContact OE2-NH1 2.86Å; E182-R257 IonicContact OE2-NH2 2.73Å; E182-R257 PolarHBondContact OE2-NH2 2.98Å
183	H	81.9	Confident	77.4	Confident	12 Å²	12	84.3 Å²	84.3	6%	0.056	39%	0.393	C	S	.	.	H	α-helix	trans	-65.2	-48.9	172.2	-172.2	103.3	0	0	0	111.8	C162 H177 L178 S180 L185 N186 V187	C162-H183 PolarHBondContact SG-CE1 3.13Å; C162-H183 PolarHBondContact SG-ND1 3.15Å; H177-H183 AromaticContact CD2-ND1 3.66Å; H177-H183 AromaticContact CE1-ND1 3.61Å; H177-H183 AromaticContact NE2-CG 3.99Å; H177-H183 AromaticContact NE2-ND1 3.06Å; H177-H183 PolarHBondContact NE2-ND1 2.87Å; H177-H183 WeakPolarHBondContact O-CB 3.29Å; L178-H183 WeakPolarHBondContact CD2-CE1 3.26Å; S180-H183 PolarHBondContact O-N 3.27Å; S180-H183 VanDerWaalsContact O-N 3.11Å; S180-H183 PolarHBondContact OG-N 3Å; S180-H183 VanDerWaalsContact OG-N 3.13Å; H183-L185 VanDerWaalsContact C-N 3.29Å; H183-L185 PolarHBondContact O-N 3.03Å; H183-N186 PolarHBondContact O-N 3.17Å; H183-V187 WeakPolarHBondContact NE2-CG2 3.38Å; H183-V187 WeakPolarHBondContact O-CG2 3.39Å; H183-V187 PolarHBondContact O-N 3.16Å
184	R	85.1	Confident	76.3	Confident	124 Å²	124	88.2 Å²	88.2	47%	0.468	42%	0.421	S	S	.	.	H	α-helix	trans	-58.4	-39.2	178.9	-64.8	174.2	92.5	-161.2	14.6	111.9	S180 E181 R188	S180-R184 VanDerWaalsContact O-CG 3.3Å; S180-R184 WeakPolarHBondContact O-CG 3.17Å; S180-R184 PolarHBondContact O-N 2.9Å; E181-R184 PolarHBondContact O-N 2.75Å; E181-R184 WeakPolarHBondContact OE1-CD 3.25Å; E181-R184 IonicContact OE1-CZ 3.4Å; E181-R184 IonicContact OE1-NE 2.73Å; E181-R184 IonicContact OE1-NH1 2.7Å; E181-R184 PolarHBondContact OE1-NH1 2.82Å; R184-R188 VanDerWaalsContact O-CG 3.28Å; R184-R188 WeakPolarHBondContact O-CG 3.42Å; R184-R188 PolarHBondContact O-N 2.86Å
185	L	83.2	Confident	74.7	Confident	88 Å²	88	93.5 Å²	93.5	46%	0.461	45%	0.451	S	S	.	.	H	α-helix	trans	-67.5	-38.9	174.4	-73.9	168.2	0	0	0	112.4	E181 H183 R188 R189	E181-L185 VanDerWaalsContact O-CB 3.24Å; E181-L185 WeakPolarHBondContact O-CB 3.26Å; E181-L185 WeakPolarHBondContact O-CD1 3.36Å; E181-L185 WeakPolarHBondContact O-CG 3.28Å; E181-L185 PolarHBondContact O-N 3.31Å; H183-L185 VanDerWaalsContact C-N 3.29Å; H183-L185 PolarHBondContact O-N 3.03Å; L185-R188 PolarHBondContact O-N 3.04Å; L185-R189 WeakPolarHBondContact O-CB 3.34Å; L185-R189 PolarHBondContact O-N 3.47Å
186	N	79.9	Confident	73	Confident	29 Å²	29	92 Å²	92	16%	0.155	45%	0.451	C	S	.	.	H	α-helix	trans	-68.5	-39.3	174.8	-73.1	-34.3	0	0	0	112.2	I164 C165 E182 H183 R188 R189 L190	I164-N186 HydrophobicContact CG2-CB 4Å; C165-N186 PolarHBondContact SG-ND2 3.32Å; E182-N186 PolarHBondContact O-N 2.64Å; E182-N186 PolarHBondContact O-ND2 3.43Å; E182-N186 VanDerWaalsContact O-ND2 3.13Å; H183-N186 PolarHBondContact O-N 3.17Å; N186-R188 PolarHBondContact O-N 3.32Å; N186-R189 PolarHBondContact O-N 3.44Å; N186-R189 PolarHBondContact OD1-NH1 3.46Å; N186-L190 WeakPolarHBondContact O-CG 3.49Å; N186-L190 PolarHBondContact O-N 2.98Å
187	V	84.6	Confident	71.3	Confident	42 Å²	42	93.1 Å²	93.1	26%	0.255	47%	0.469	S	S	.	.	H	α-helix	trans	-58.3	-47.5	170.2	173.9	0	0	0	0	111.2	I164 H183 R189 L190 K191	I164-V187 HydrophobicContact CD1-CG2 4.06Å; I164-V187 HydrophobicContact CG2-CG2 3.86Å; H183-V187 WeakPolarHBondContact NE2-CG2 3.38Å; H183-V187 WeakPolarHBondContact O-CG2 3.39Å; H183-V187 PolarHBondContact O-N 3.16Å; V187-R189 VanDerWaalsContact C-N 3.34Å; V187-R189 PolarHBondContact O-N 2.93Å; V187-L190 PolarHBondContact O-N 3.48Å; V187-K191 HydrophobicContact CG1-CD 4.46Å; V187-K191 PolarHBondContact O-N 3.34Å
188	R	86.5	Confident	69.6	Low	135 Å²	135	95.2 Å²	95.2	51%	0.509	49%	0.49	S	S	.	.	H	α-helix	trans	-59.2	-42.9	176.2	-73.7	169.5	-179.2	151.6	1.2	111.6	E181 R184 L185 N186 K191 G192	E181-R188 IonicContact OE2-NH1 3.7Å; R184-R188 VanDerWaalsContact O-CG 3.28Å; R184-R188 WeakPolarHBondContact O-CG 3.42Å; R184-R188 PolarHBondContact O-N 2.86Å; L185-R188 PolarHBondContact O-N 3.04Å; N186-R188 PolarHBondContact O-N 3.32Å; R188-K191 PolarHBondContact O-N 3.02Å; R188-G192 PolarHBondContact O-N 3.03Å
189	R	82	Confident	67.7	Low	155 Å²	155	98 Å²	98	59%	0.585	51%	0.512	S	S	*	.	H	α-helix	trans	-69.5	-29	179.1	-170.5	-176.3	-70.5	130.3	-4.6	113.6	L185 N186 V187 G192	L185-R189 WeakPolarHBondContact O-CB 3.34Å; L185-R189 PolarHBondContact O-N 3.47Å; N186-R189 PolarHBondContact O-N 3.44Å; N186-R189 PolarHBondContact OD1-NH1 3.46Å; V187-R189 VanDerWaalsContact C-N 3.34Å; V187-R189 PolarHBondContact O-N 2.93Å; R189-G192 VanDerWaalsContact O-O 3.12Å
190	L	79.4	Confident	65.9	Low	113 Å²	113	103.6 Å²	103.6	59%	0.592	53%	0.527	S	S	*	.	H	α-helix	trans	-73.7	-41.9	171.9	-73.3	174.5	0	0	0	112	I164 N186 V187	I164-L190 HydrophobicContact CB-CD1 4.16Å; I164-L190 HydrophobicContact CG1-CD1 4.02Å; I164-L190 HydrophobicContact CG2-CD1 3.85Å; N186-L190 WeakPolarHBondContact O-CG 3.49Å; N186-L190 PolarHBondContact O-N 2.98Å; V187-L190 PolarHBondContact O-N 3.48Å
191	K	74.2	Confident	64.7	Low	186 Å²	186	106.6 Å²	106.6	81%	0.809	55%	0.545	S	S	*	.	H	α-helix	trans	-72.1	-38.3	179.2	-70	-168.8	174.2	-165	0	112.8	V187 R188	V187-K191 HydrophobicContact CG1-CD 4.46Å; V187-K191 PolarHBondContact O-N 3.34Å; R188-K191 PolarHBondContact O-N 3.02Å
192	G	63.6	Low	63.7	Low	32 Å²	32	106.6 Å²	106.6	33%	0.33	55%	0.548	S	S	.	.			trans	-101.5	109.8	177.7	0	0	0	0	0	112.6	R188 R189 S194	R188-G192 PolarHBondContact O-N 3.03Å; R189-G192 VanDerWaalsContact O-O 3.12Å; G192-S194 PolarHBondContact O-N 3.29Å
193	K	53.9	Low	63.3	Low	207 Å²	207	107.7 Å²	107.7	90%	0.9	56%	0.555	S	S	*	*			trans	-66.2	22.1	169	-73	-176.4	176.1	174.8	0	114.3
194	S	41.8	Very low	63.1	Low	96 Å²	96	109 Å²	109	67%	0.671	57%	0.566	S	S	*	*			trans	-91.2	108.5	175.2	-173.7	0	0	0	0	109.5	G192 S196	G192-S194 PolarHBondContact O-N 3.29Å; S194-S196 VanDerWaalsContact C-N 3.28Å; S194-S196 PolarHBondContact O-N 3.03Å
195	L	44	Very low	62.9	Low	161 Å²	161	108 Å²	108	84%	0.843	58%	0.575	S	S	*	*			trans	-76	83.2	168.8	-80.2	78.5	0	0	0	109	P197	L195-P197 WeakPolarHBondContact O-CD 3.36Å
196	S	41.9	Very low	62.7	Low	91 Å²	91	109.1 Å²	109.1	64%	0.636	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-65.1	119.6	151.8	53.3	0	0	0	0	107.6	S194 G198	S194-S196 VanDerWaalsContact C-N 3.28Å; S194-S196 PolarHBondContact O-N 3.03Å; S196-G198 PolarHBondContact O-N 3.15Å; S196-G198 VanDerWaalsContact O-N 3.13Å
197	P	38.5	Very low	62.2	Low	125 Å²	125	108 Å²	108	81%	0.812	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-64.6	118.7	172.5	26.6	-31.9	0	0	0	107.6	L195	L195-P197 WeakPolarHBondContact O-CD 3.36Å
198	G	44.1	Very low	61.7	Low	44 Å²	44	113.2 Å²	113.2	45%	0.454	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-58.7	164.2	172.4	0	0	0	0	0	111.4	S196 R200	S196-G198 PolarHBondContact O-N 3.15Å; S196-G198 VanDerWaalsContact O-N 3.13Å; G198-R200 PolarHBondContact O-N 3.19Å
199	P	43.2	Very low	61.1	Low	123 Å²	123	111 Å²	111	80%	0.799	58%	0.581	S	S	*	*	S	Bend	trans	-49.2	132.6	177.1	22.4	-34.1	0	0	0	109.7	V201	P199-V201 VanDerWaalsContact O-CG2 3.22Å; P199-V201 WeakPolarHBondContact O-CG2 3.33Å; P199-V201 PolarHBondContact O-N 2.79Å
200	R	44.4	Very low	60.5	Low	253 Å²	253	104.5 Å²	104.5	96%	0.955	56%	0.557	S	S	*	*			trans	-54.7	98.4	-167.6	-75.2	-173.8	177.2	-174.2	0.3	110.8	G198 D202	G198-R200 PolarHBondContact O-N 3.19Å; R200-D202 PolarHBondContact O-N 3.35Å; R200-D202 VanDerWaalsContact O-N 3.16Å
201	V	53.3	Low	60	Low	84 Å²	84	101 Å²	101	51%	0.509	54%	0.537	S	S	.	.			trans	-70.2	112.5	-171.4	-177.6	0	0	0	0	109.1	P199 N203 S229	P199-V201 VanDerWaalsContact O-CG2 3.22Å; P199-V201 WeakPolarHBondContact O-CG2 3.33Å; P199-V201 PolarHBondContact O-N 2.79Å; V201-N203 WeakPolarHBondContact CG1-ND2 3.27Å; V201-N203 PolarHBondContact O-N 3.31Å; V201-N203 VanDerWaalsContact O-N 3.1Å; V201-N203 PolarHBondContact O-ND2 2.81Å; V201-S229 WeakPolarHBondContact CG1-OG 3.22Å
202	D	58.2	Low	59.8	Low	96 Å²	96	100.3 Å²	100.3	51%	0.513	53%	0.53	S	S	.	.			trans	-55.2	121	168.9	-176	3.7	0	0	0	108.8	R200 S204 L207 S229	R200-D202 PolarHBondContact O-N 3.35Å; R200-D202 VanDerWaalsContact O-N 3.16Å; D202-S204 PolarHBondContact OD1-N 2.82Å; D202-S204 VanDerWaalsContact OD1-N 3.1Å; D202-L207 WeakPolarHBondContact O-CD2 3.47Å; D202-S229 WeakPolarHBondContact O-CB 3.28Å; D202-S229 PolarHBondContact O-OG 3.48Å
203	N	66.2	Low	60	Low	65 Å²	65	99 Å²	99	35%	0.348	52%	0.515	S	S	.	.			trans	-141.7	49.9	-176.2	-87.7	-50.4	0	0	0	107.9	V201 R208 K211	V201-N203 WeakPolarHBondContact CG1-ND2 3.27Å; V201-N203 PolarHBondContact O-N 3.31Å; V201-N203 VanDerWaalsContact O-N 3.1Å; V201-N203 PolarHBondContact O-ND2 2.81Å; N203-R208 VanDerWaalsContact O-CZ 3.28Å; N203-R208 PolarHBondContact O-NE 3.34Å; N203-R208 PolarHBondContact O-NH2 2.75Å; N203-K211 PolarHBondContact OD1-NZ 2.73Å
204	S	77.7	Confident	60.3	Low	41 Å²	41	89.1 Å²	89.1	29%	0.287	47%	0.472	S	S	.	.			trans	-46.1	152.4	167.9	73.2	0	0	0	0	111.9	D202 H206 L207 R208	D202-S204 PolarHBondContact OD1-N 2.82Å; D202-S204 VanDerWaalsContact OD1-N 3.1Å; S204-H206 PolarHBondContact O-N 2.65Å; S204-L207 PolarHBondContact O-N 3.1Å; S204-L207 WeakPolarHBondContact OG-CB 3.37Å; S204-L207 PolarHBondContact OG-N 2.77Å; S204-L207 VanDerWaalsContact OG-N 3.16Å; S204-R208 PolarHBondContact O-N 3.16Å; S204-R208 VanDerWaalsContact O-N 3.08Å
205	P	79.8	Confident	61.4	Low	101 Å²	101	89.1 Å²	89.1	66%	0.656	46%	0.457	S	S	*	.	H	α-helix	trans	-55.6	-35.1	175.5	-26	35.6	0	0	0	112.6	R208 K209	P205-R208 PolarHBondContact O-N 2.61Å; P205-K209 PolarHBondContact O-N 3.14Å
206	H	78.8	Confident	62.3	Low	112 Å²	112	85.5 Å²	85.5	52%	0.519	44%	0.436	S	S	.	.	H	α-helix	trans	-59.1	-55.5	174.4	-169.2	-95.9	0	0	0	111.8	S204 R208 K209 F210 E236	S204-H206 PolarHBondContact O-N 2.65Å; H206-R208 PolarHBondContact O-N 2.77Å; H206-K209 WeakPolarHBondContact O-CA 3.36Å; H206-K209 PolarHBondContact O-N 3.16Å; H206-F210 PolarHBondContact O-N 2.68Å; H206-E236 VanDerWaalsContact CE1-CD 3.48Å; H206-E236 IonicContact CE1-OE1 3.82Å; H206-E236 IonicContact CE1-OE2 2.82Å; H206-E236 PolarHBondContact CE1-OE2 3.48Å; H206-E236 VanDerWaalsContact CE1-OE2 3.29Å; H206-E236 IonicContact ND1-OE1 3.73Å; H206-E236 IonicContact ND1-OE2 2.72Å; H206-E236 PolarHBondContact ND1-OE2 3.39Å
207	L	69.8	Low	63	Low	7 Å²	7	81.6 Å²	81.6	4%	0.037	41%	0.409	C	S	.	.	H	α-helix	trans	-63.4	-27.9	-178.5	-165.8	67.1	0	0	0	111.9	D202 S204 K211 S229 A232	D202-L207 WeakPolarHBondContact O-CD2 3.47Å; S204-L207 PolarHBondContact O-N 3.1Å; S204-L207 WeakPolarHBondContact OG-CB 3.37Å; S204-L207 PolarHBondContact OG-N 2.77Å; S204-L207 VanDerWaalsContact OG-N 3.16Å; L207-K211 VanDerWaalsContact O-CB 3.32Å; L207-K211 WeakPolarHBondContact O-CB 3.49Å; L207-K211 VanDerWaalsContact O-CG 3.25Å; L207-K211 WeakPolarHBondContact O-CG 3.23Å; L207-K211 PolarHBondContact O-N 3.1Å; L207-S229 WeakPolarHBondContact CD2-OG 3.41Å; L207-A232 HydrophobicContact CD1-CB 3.77Å; L207-A232 HydrophobicContact CG-CB 4.38Å
208	R	74.4	Confident	64.1	Low	150 Å²	150	75.7 Å²	75.7	57%	0.566	37%	0.37	S	S	*	.	H	α-helix	trans	-72	-37.5	170.6	-80	-177.6	-85.1	157.6	-8.9	113.5	N203 S204 P205 H206 R212	N203-R208 VanDerWaalsContact O-CZ 3.28Å; N203-R208 PolarHBondContact O-NE 3.34Å; N203-R208 PolarHBondContact O-NH2 2.75Å; S204-R208 PolarHBondContact O-N 3.16Å; S204-R208 VanDerWaalsContact O-N 3.08Å; P205-R208 PolarHBondContact O-N 2.61Å; H206-R208 PolarHBondContact O-N 2.77Å; R208-R212 PolarHBondContact O-N 3.05Å
209	K	74.7	Confident	64.6	Low	89 Å²	89	77.1 Å²	77.1	39%	0.387	37%	0.37	S	S	.	.	H	α-helix	trans	-66	-45.8	171.1	-159.7	-172.2	-167.8	-163.9	0	110.1	T59 D61 P205 H206 R212 S213	T59-K209 HydrophobicContact CG2-CD 4.08Å; T59-K209 HydrophobicContact CG2-CG 4.35Å; T59-K209 PolarHBondContact OG1-NZ 3.02Å; D61-K209 PolarHBondContact O-NZ 3.46Å; D61-K209 VanDerWaalsContact O-NZ 3.09Å; P205-K209 PolarHBondContact O-N 3.14Å; H206-K209 WeakPolarHBondContact O-CA 3.36Å; H206-K209 PolarHBondContact O-N 3.16Å; K209-R212 WeakPolarHBondContact O-CB 3.36Å; K209-R212 PolarHBondContact O-N 3.49Å; K209-R212 VanDerWaalsContact O-N 3.09Å; K209-S213 PolarHBondContact O-N 2.84Å
210	F	69.7	Low	65	Low	19 Å²	19	72.9 Å²	72.9	8%	0.083	34%	0.342	C	S	.	.	H	α-helix	trans	-58.9	-51.5	178	-173.3	-99.2	0	0	0	112.5	P55 H206 R212 S213 C214 A232 L235 E236	P55-F210 HydrophobicContact CB-CE2 4.26Å; H206-F210 PolarHBondContact O-N 2.68Å; F210-R212 PolarHBondContact O-N 3.02Å; F210-R212 VanDerWaalsContact O-N 3.07Å; F210-S213 PolarHBondContact O-N 2.98Å; F210-C214 WeakPolarHBondContact CE1-SG 3.33Å; F210-C214 WeakPolarHBondContact CZ-SG 3.34Å; F210-C214 PolarHBondContact O-N 3.2Å; F210-A232 HydrophobicContact CD1-CB 4.41Å; F210-A232 WeakPolarHBondContact CE1-O 3.29Å; F210-L235 HydrophobicContact CE1-CB 3.8Å; F210-L235 HydrophobicContact CZ-CB 3.96Å; F210-E236 HydrophobicContact CD1-CB 4.17Å; F210-E236 HydrophobicContact CD1-CG 4.44Å; F210-E236 HydrophobicContact CD2-CB 4.33Å; F210-E236 HydrophobicContact CD2-CG 3.88Å; F210-E236 HydrophobicContact CE1-CB 3.87Å; F210-E236 HydrophobicContact CE1-CG 4.46Å; F210-E236 HydrophobicContact CE2-CB 4.03Å; F210-E236 HydrophobicContact CE2-CG 3.89Å; F210-E236 HydrophobicContact CG-CB 4.4Å; F210-E236 HydrophobicContact CG-CG 4.17Å; F210-E236 VanDerWaalsContact CZ-CA 3.44Å; F210-E236 HydrophobicContact CZ-CB 3.8Å; F210-E236 HydrophobicContact CZ-CG 4.2Å
211	K	68.6	Low	65.4	Low	38 Å²	38	61 Å²	61	17%	0.165	30%	0.298	C	S	.	.	H	α-helix	trans	-60	-19	175.2	-75.7	175.6	-177.1	175.3	0	114.4	N203 L207 R215 S229 A232	N203-K211 PolarHBondContact OD1-NZ 2.73Å; L207-K211 VanDerWaalsContact O-CB 3.32Å; L207-K211 WeakPolarHBondContact O-CB 3.49Å; L207-K211 VanDerWaalsContact O-CG 3.25Å; L207-K211 WeakPolarHBondContact O-CG 3.23Å; L207-K211 PolarHBondContact O-N 3.1Å; K211-R215 WeakPolarHBondContact O-CG 3.44Å; K211-S229 PolarHBondContact NZ-OG 2.81Å; K211-A232 HydrophobicContact CD-CB 4.1Å; K211-A232 HydrophobicContact CG-CB 3.6Å
212	R	69.3	Low	65.6	Low	173 Å²	173	57.7 Å²	57.7	65%	0.653	28%	0.276	S	S	*	.	H	α-helix	trans	-80.5	-50.6	169.6	172.6	179.8	-74.5	171.1	-5.6	110.7	R208 K209 F210 C214 R215 E216	R208-R212 PolarHBondContact O-N 3.05Å; K209-R212 WeakPolarHBondContact O-CB 3.36Å; K209-R212 PolarHBondContact O-N 3.49Å; K209-R212 VanDerWaalsContact O-N 3.09Å; F210-R212 PolarHBondContact O-N 3.02Å; F210-R212 VanDerWaalsContact O-N 3.07Å; R212-C214 VanDerWaalsContact C-N 3.27Å; R212-C214 PolarHBondContact O-N 3.48Å; R212-R215 WeakPolarHBondContact O-CA 3.36Å; R212-R215 VanDerWaalsContact O-CB 3.32Å; R212-R215 WeakPolarHBondContact O-CB 3.46Å; R212-R215 PolarHBondContact O-N 3.07Å; R212-E216 WeakPolarHBondContact CD-OE1 3.48Å; R212-E216 WeakPolarHBondContact CG-OE1 3.05Å; R212-E216 PolarHBondContact O-N 3.22Å; R212-E216 VanDerWaalsContact O-N 3.1Å
213	S	66.7	Low	65.5	Low	3 Å²	3	55 Å²	55	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-55.6	-41.9	176.7	-176.7	0	0	0	0	112	P55 V58 K209 F210 R215 E216 V217	P55-S213 PolarHBondContact O-OG 3.38Å; V58-S213 WeakPolarHBondContact O-CB 3.27Å; V58-S213 PolarHBondContact O-OG 3.45Å; K209-S213 PolarHBondContact O-N 2.84Å; F210-S213 PolarHBondContact O-N 2.98Å; S213-R215 PolarHBondContact O-N 3.1Å; S213-E216 PolarHBondContact O-N 3.47Å; S213-V217 PolarHBondContact O-N 3.27Å; S213-V217 VanDerWaalsContact O-N 3.1Å
214	C	62	Low	65.1	Low	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.2	-25.1	175.3	-68.1	0	0	0	0	114.5	F210 R212 F227 H261	F210-C214 WeakPolarHBondContact CE1-SG 3.33Å; F210-C214 WeakPolarHBondContact CZ-SG 3.34Å; F210-C214 PolarHBondContact O-N 3.2Å; R212-C214 VanDerWaalsContact C-N 3.27Å; R212-C214 PolarHBondContact O-N 3.48Å; C214-F227 HydrophobicContact CB-CD2 4.2Å; C214-F227 HydrophobicContact CB-CE2 3.83Å; C214-H261 VanDerWaalsContact CA-CE1 3.49Å; C214-H261 WeakPolarHBondContact CA-CE1 3.22Å; C214-H261 PolarHBondContact O-ND1 2.78Å
215	R	64.8	Low	64.6	Low	96 Å²	96	52.6 Å²	52.6	36%	0.362	26%	0.259	S	S	.	.	H	α-helix	trans	-77.5	-38.6	170.1	-68.7	172.3	175.3	-75.6	-11	111.5	K211 R212 S213 V217 L218 V219 I225	K211-R215 WeakPolarHBondContact O-CG 3.44Å; R212-R215 WeakPolarHBondContact O-CA 3.36Å; R212-R215 VanDerWaalsContact O-CB 3.32Å; R212-R215 WeakPolarHBondContact O-CB 3.46Å; R212-R215 PolarHBondContact O-N 3.07Å; S213-R215 PolarHBondContact O-N 3.1Å; R215-V217 VanDerWaalsContact C-N 3.34Å; R215-V217 PolarHBondContact O-N 2.99Å; R215-L218 CarbonylContact O-C 3.53Å; R215-L218 WeakPolarHBondContact O-CA 3.22Å; R215-L218 PolarHBondContact O-N 3.14Å; R215-V219 WeakPolarHBondContact O-CG2 3.47Å; R215-V219 PolarHBondContact O-N 3.16Å; R215-I225 PolarHBondContact NH1-O 3.12Å; R215-I225 PolarHBondContact NH2-O 2.96Å
216	E	62	Low	64.1	Low	85 Å²	85	51.3 Å²	51.3	40%	0.397	24%	0.244	S	C	.	.	H	α-helix	trans	-62	-43.6	-179.5	-70.8	163.8	-164.3	0	0	110.8	R212 S213 L218 V219	R212-E216 WeakPolarHBondContact CD-OE1 3.48Å; R212-E216 WeakPolarHBondContact CG-OE1 3.05Å; R212-E216 PolarHBondContact O-N 3.22Å; R212-E216 VanDerWaalsContact O-N 3.1Å; S213-E216 PolarHBondContact O-N 3.47Å; E216-L218 PolarHBondContact O-N 3.18Å; E216-V219 PolarHBondContact O-N 3.23Å
217	V	56	Low	64	Low	10 Å²	10	47 Å²	47	6%	0.061	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-33.4	168.8	171.1	0	0	0	0	113	V58 S213 R215 N264 A265 I268	V58-V217 HydrophobicContact CG2-CG2 4.5Å; S213-V217 PolarHBondContact O-N 3.27Å; S213-V217 VanDerWaalsContact O-N 3.1Å; R215-V217 VanDerWaalsContact C-N 3.34Å; R215-V217 PolarHBondContact O-N 2.99Å; V217-N264 PolarHBondContact O-ND2 2.96Å; V217-A265 HydrophobicContact CG1-CB 4.37Å; V217-I268 HydrophobicContact CG1-CD1 4.18Å
218	L	61.8	Low	64.5	Low	0 Å²	0	49 Å²	49	0%	0	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-11	-175.3	-83.2	176.1	0	0	0	115.1	R215 E216 P220 V221 Y222 I225 F227 I260 H261 N264	R215-L218 CarbonylContact O-C 3.53Å; R215-L218 WeakPolarHBondContact O-CA 3.22Å; R215-L218 PolarHBondContact O-N 3.14Å; E216-L218 PolarHBondContact O-N 3.18Å; L218-P220 VanDerWaalsContact C-CD 3.46Å; L218-P220 VanDerWaalsContact C-N 3.32Å; L218-V221 HydrophobicContact CD2-CB 4.33Å; L218-V221 CarbonylContact O-C 3.31Å; L218-V221 PolarHBondContact O-N 2.86Å; L218-Y222 CarbonylContact O-C 3.55Å; L218-Y222 VanDerWaalsContact O-C 3.3Å; L218-Y222 WeakPolarHBondContact O-CA 3.25Å; L218-Y222 PolarHBondContact O-N 3.38Å; L218-I225 HydrophobicContact CD1-CB 4.33Å; L218-I225 HydrophobicContact CD1-CD1 3.72Å; L218-I225 HydrophobicContact CD1-CG2 3.69Å; L218-F227 HydrophobicContact CD1-CE2 4.21Å; L218-F227 HydrophobicContact CD1-CZ 3.92Å; L218-I260 HydrophobicContact CD2-CG2 4.38Å; L218-H261 HydrophobicContact CD1-CB 3.85Å; L218-H261 HydrophobicContact CG-CB 4.38Å; L218-N264 HydrophobicContact CD2-CB 4.5Å
219	V	55.7	Low	64.8	Low	74 Å²	74	42.9 Å²	42.9	45%	0.448	22%	0.216	S	C	.	.	H	α-helix	trans	-53.1	-41.1	-175.9	151.9	0	0	0	0	113.6	R215 E216 V221	R215-V219 WeakPolarHBondContact O-CG2 3.47Å; R215-V219 PolarHBondContact O-N 3.16Å; E216-V219 PolarHBondContact O-N 3.23Å; V219-V221 VanDerWaalsContact C-N 3.27Å; V219-V221 PolarHBondContact O-N 3.29Å
220	P	50.2	Low	65.2	Low	34 Å²	34	41.5 Å²	41.5	22%	0.221	22%	0.222	C	C	.	.	H	α-helix	trans	-67.4	-20.1	176.1	-21.4	34.2	0	0	0	115.2	L218 G306 Q317	L218-P220 VanDerWaalsContact C-CD 3.46Å; L218-P220 VanDerWaalsContact C-N 3.32Å; P220-G306 WeakPolarHBondContact O-CA 3.24Å; P220-Q317 HydrophobicContact CG-CG 4.47Å
221	V	53.2	Low	66	Low	4 Å²	4	40.8 Å²	40.8	2%	0.024	22%	0.218	C	C	.	.	H	α-helix	trans	-120.2	-20.3	-169.5	-177.1	0	0	0	0	112.9	L218 V219 I260 F305 L320	L218-V221 HydrophobicContact CD2-CB 4.33Å; L218-V221 CarbonylContact O-C 3.31Å; L218-V221 PolarHBondContact O-N 2.86Å; V219-V221 VanDerWaalsContact C-N 3.27Å; V219-V221 PolarHBondContact O-N 3.29Å; V221-I260 HydrophobicContact CG1-CD1 4.19Å; V221-I260 HydrophobicContact CG1-CG1 4.07Å; V221-F305 VanDerWaalsContact C-CE1 3.49Å; V221-F305 HydrophobicContact CG1-CD1 4.29Å; V221-F305 WeakPolarHBondContact O-CE1 3.27Å; V221-L320 HydrophobicContact CG1-CD2 3.86Å; V221-L320 HydrophobicContact CG2-CB 4.17Å
222	Y	58.9	Low	66.7	Low	15 Å²	15	39 Å²	39	6%	0.059	21%	0.211	C	C	.	.	H	α-helix	trans	-174.3	55	-168.7	-147.2	-47	0	0	0	111.9	V168 L218 S224 I225 I260	V168-Y222 HydrophobicContact CB-CD1 4.28Å; V168-Y222 HydrophobicContact CB-CE1 3.71Å; V168-Y222 HydrophobicContact CB-CE2 4.5Å; V168-Y222 HydrophobicContact CG2-CE1 4.23Å; V168-Y222 PolarHBondContact N-OH 3.3Å; V168-Y222 WeakPolarHBondContact O-CE2 3.45Å; V168-Y222 PolarHBondContact O-OH 3.28Å; L218-Y222 CarbonylContact O-C 3.55Å; L218-Y222 VanDerWaalsContact O-C 3.3Å; L218-Y222 WeakPolarHBondContact O-CA 3.25Å; L218-Y222 PolarHBondContact O-N 3.38Å; Y222-S224 PolarHBondContact O-N 2.85Å; Y222-I225 HydrophobicContact CD1-CB 3.47Å; Y222-I225 VanDerWaalsContact CD1-CB 3.47Å; Y222-I225 HydrophobicContact CD1-CD1 3.94Å; Y222-I225 HydrophobicContact CD1-CG1 3.71Å; Y222-I225 HydrophobicContact CD2-CD1 3.68Å; Y222-I225 HydrophobicContact CD2-CG1 4.32Å; Y222-I225 HydrophobicContact CE1-CB 3.67Å; Y222-I225 HydrophobicContact CE1-CD1 3.93Å; Y222-I225 HydrophobicContact CE1-CG1 3.48Å; Y222-I225 VanDerWaalsContact CE1-CG1 3.48Å; Y222-I225 HydrophobicContact CE2-CD1 3.66Å; Y222-I225 HydrophobicContact CE2-CG1 4.13Å; Y222-I225 HydrophobicContact CG-CB 4Å; Y222-I225 HydrophobicContact CG-CD1 3.77Å; Y222-I225 HydrophobicContact CG-CG1 4.09Å; Y222-I225 PolarHBondContact O-N 2.91Å; Y222-I225 VanDerWaalsContact O-N 3.09Å; Y222-I260 HydrophobicContact CD2-CG2 4.04Å; Y222-I260 HydrophobicContact CE2-CG2 4.38Å
223	G	54.8	Low	67.4	Low	40 Å²	40	36.2 Å²	36.2	41%	0.412	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-26.1	179.9	0	0	0	0	0	115.6
224	S	59.1	Low	68.4	Low	54 Å²	54	36.2 Å²	36.2	38%	0.378	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-13.1	180	-54.7	0	0	0	0	115.4	Y222	Y222-S224 PolarHBondContact O-N 2.85Å
225	I	65.8	Low	69.5	Low	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.203	C	C	.	.			trans	-58.8	148.4	-166	-137.8	162	0	0	0	112.2	R215 L218 Y222 F227 R257 I260	R215-I225 PolarHBondContact NH1-O 3.12Å; R215-I225 PolarHBondContact NH2-O 2.96Å; L218-I225 HydrophobicContact CD1-CB 4.33Å; L218-I225 HydrophobicContact CD1-CD1 3.72Å; L218-I225 HydrophobicContact CD1-CG2 3.69Å; Y222-I225 HydrophobicContact CD1-CB 3.47Å; Y222-I225 VanDerWaalsContact CD1-CB 3.47Å; Y222-I225 HydrophobicContact CD1-CD1 3.94Å; Y222-I225 HydrophobicContact CD1-CG1 3.71Å; Y222-I225 HydrophobicContact CD2-CD1 3.68Å; Y222-I225 HydrophobicContact CD2-CG1 4.32Å; Y222-I225 HydrophobicContact CE1-CB 3.67Å; Y222-I225 HydrophobicContact CE1-CD1 3.93Å; Y222-I225 HydrophobicContact CE1-CG1 3.48Å; Y222-I225 VanDerWaalsContact CE1-CG1 3.48Å; Y222-I225 HydrophobicContact CE2-CD1 3.66Å; Y222-I225 HydrophobicContact CE2-CG1 4.13Å; Y222-I225 HydrophobicContact CG-CB 4Å; Y222-I225 HydrophobicContact CG-CD1 3.77Å; Y222-I225 HydrophobicContact CG-CG1 4.09Å; Y222-I225 PolarHBondContact O-N 2.91Å; Y222-I225 VanDerWaalsContact O-N 3.09Å; I225-F227 HydrophobicContact CD1-CE1 4.49Å; I225-F227 HydrophobicContact CD1-CZ 4.14Å; I225-F227 HydrophobicContact CG2-CD2 4.1Å; I225-F227 HydrophobicContact CG2-CE2 3.5Å; I225-F227 HydrophobicContact CG2-CZ 3.89Å; I225-R257 HydrophobicContact CD1-CB 3.87Å; I225-R257 HydrophobicContact CD1-CG 3.99Å; I225-R257 HydrophobicContact CG1-CB 4.28Å; I225-R257 HydrophobicContact CG1-CG 4.03Å; I225-I260 HydrophobicContact CD1-CG2 4.08Å
226	K	70	Confident	70.2	Confident	75 Å²	75	33.1 Å²	33.1	33%	0.326	19%	0.193	S	C	.	.			trans	-135.7	126.3	174.5	-46.6	177.9	-173.7	166	0	107.2	F167 R257	F167-K226 HydrophobicContact CE1-CB 4.14Å; F167-K226 HydrophobicContact CE1-CD 4.34Å; F167-K226 HydrophobicContact CE1-CG 4.42Å; K226-R257 WeakPolarHBondContact O-CD 3.41Å
227	F	76.7	Confident	71.1	Confident	20 Å²	20	31 Å²	31	9%	0.088	18%	0.184	C	C	.	.			trans	-98.8	137.3	175	-64.3	-72.8	0	0	0	110.5	C214 L218 I225 E231 A232 L235 R257 I258 H261	C214-F227 HydrophobicContact CB-CD2 4.2Å; C214-F227 HydrophobicContact CB-CE2 3.83Å; L218-F227 HydrophobicContact CD1-CE2 4.21Å; L218-F227 HydrophobicContact CD1-CZ 3.92Å; I225-F227 HydrophobicContact CD1-CE1 4.49Å; I225-F227 HydrophobicContact CD1-CZ 4.14Å; I225-F227 HydrophobicContact CG2-CD2 4.1Å; I225-F227 HydrophobicContact CG2-CE2 3.5Å; I225-F227 HydrophobicContact CG2-CZ 3.89Å; F227-E231 WeakPolarHBondContact CA-OE2 3.48Å; F227-E231 HydrophobicContact CB-CB 4.19Å; F227-E231 HydrophobicContact CD1-CB 3.99Å; F227-A232 HydrophobicContact CB-CB 4.2Å; F227-L235 HydrophobicContact CD1-CD1 3.81Å; F227-L235 HydrophobicContact CD2-CD1 4.44Å; F227-L235 HydrophobicContact CE1-CD1 3.51Å; F227-L235 HydrophobicContact CE2-CD1 4.21Å; F227-L235 HydrophobicContact CG-CD1 4.26Å; F227-L235 HydrophobicContact CZ-CD1 3.75Å; F227-R257 HydrophobicContact CD1-CB 4.21Å; F227-R257 HydrophobicContact CE1-CB 3.75Å; F227-R257 WeakPolarHBondContact CE1-O 3.48Å; F227-I258 HydrophobicContact CE1-CG1 4.49Å; F227-H261 HydrophobicContact CZ-CB 4.03Å
228	T	81.1	Confident	72.4	Confident	50 Å²	50	30.5 Å²	30.5	31%	0.307	18%	0.181	S	C	.	.			trans	-63.6	169.2	163.5	65	0	0	0	0	110.5	A230 E231 A232	T228-A230 VanDerWaalsContact C-N 3.28Å; T228-E231 VanDerWaalsContact CB-OE1 3.29Å; T228-E231 WeakPolarHBondContact CB-OE1 3.21Å; T228-E231 WeakPolarHBondContact CG2-OE1 3.42Å; T228-E231 PolarHBondContact N-OE2 3.5Å; T228-E231 WeakPolarHBondContact OG1-CG 3.4Å; T228-E231 PolarHBondContact OG1-N 3.43Å; T228-E231 VanDerWaalsContact OG1-N 3.16Å; T228-E231 PolarHBondContact OG1-OE1 2.95Å; T228-A232 VanDerWaalsContact O-CB 3.25Å; T228-A232 WeakPolarHBondContact O-CB 3.45Å; T228-A232 PolarHBondContact O-N 2.92Å
229	S	79.3	Confident	73	Confident	21 Å²	21	30.8 Å²	30.8	15%	0.147	18%	0.184	C	C	.	.	H	α-helix	trans	-69	-27.2	172.5	-74.2	0	0	0	0	113.1	V201 D202 L207 K211 K233	V201-S229 WeakPolarHBondContact CG1-OG 3.22Å; D202-S229 WeakPolarHBondContact O-CB 3.28Å; D202-S229 PolarHBondContact O-OG 3.48Å; L207-S229 WeakPolarHBondContact CD2-OG 3.41Å; K211-S229 PolarHBondContact NZ-OG 2.81Å; S229-K233 VanDerWaalsContact O-CB 3.28Å; S229-K233 WeakPolarHBondContact O-CB 3.44Å; S229-K233 PolarHBondContact O-N 2.84Å
230	A	83.6	Confident	73.7	Confident	61 Å²	61	32.5 Å²	32.5	50%	0.504	19%	0.185	S	C	.	.	H	α-helix	trans	-65.9	-56	172.9	0	0	0	0	0	110.4	T228 A232 K233 L234	T228-A230 VanDerWaalsContact C-N 3.28Å; A230-A232 VanDerWaalsContact C-N 3.3Å; A230-A232 PolarHBondContact O-N 2.91Å; A230-K233 PolarHBondContact O-N 2.91Å; A230-K233 VanDerWaalsContact O-N 3.11Å; A230-L234 WeakPolarHBondContact O-CB 3.07Å; A230-L234 PolarHBondContact O-N 2.9Å
231	E	85.7	Confident	74.7	Confident	3 Å²	3	31.7 Å²	31.7	1%	0.014	18%	0.183	C	C	.	.	H	α-helix	trans	-56.1	-43.2	176.9	-72.4	146.6	-119.9	0	0	112.8	F227 T228 K233 L234 L235 L249 R257 I258	F227-E231 WeakPolarHBondContact CA-OE2 3.48Å; F227-E231 HydrophobicContact CB-CB 4.19Å; F227-E231 HydrophobicContact CD1-CB 3.99Å; T228-E231 VanDerWaalsContact CB-OE1 3.29Å; T228-E231 WeakPolarHBondContact CB-OE1 3.21Å; T228-E231 WeakPolarHBondContact CG2-OE1 3.42Å; T228-E231 PolarHBondContact N-OE2 3.5Å; T228-E231 WeakPolarHBondContact OG1-CG 3.4Å; T228-E231 PolarHBondContact OG1-N 3.43Å; T228-E231 VanDerWaalsContact OG1-N 3.16Å; T228-E231 PolarHBondContact OG1-OE1 2.95Å; E231-K233 PolarHBondContact O-N 3.24Å; E231-L234 PolarHBondContact O-N 2.95Å; E231-L235 VanDerWaalsContact O-CB 3.29Å; E231-L235 WeakPolarHBondContact O-CB 3.42Å; E231-L235 WeakPolarHBondContact O-CG 3.08Å; E231-L235 PolarHBondContact O-N 3.14Å; E231-L249 HydrophobicContact CG-CD2 4.38Å; E231-R257 IonicContact OE1-CZ 3.38Å; E231-R257 IonicContact OE1-NE 2.96Å; E231-R257 IonicContact OE1-NH2 3.16Å; E231-R257 PolarHBondContact OE1-NH2 2.84Å; E231-R257 IonicContact OE2-CZ 3.62Å; E231-R257 IonicContact OE2-NE 3.24Å; E231-R257 PolarHBondContact OE2-NE 3.41Å; E231-R257 IonicContact OE2-NH2 3.81Å; E231-R257 PolarHBondContact OE2-NH2 3.09Å; E231-R257 VanDerWaalsContact OE2-NH2 3.16Å; E231-I258 HydrophobicContact CB-CD1 3.97Å; E231-I258 HydrophobicContact CB-CG1 4.18Å; E231-I258 HydrophobicContact CG-CD1 3.98Å; E231-I258 HydrophobicContact CG-CG1 4.24Å
232	A	83.6	Confident	75.7	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.008	20%	0.201	C	C	.	.	H	α-helix	trans	-65.8	-37.4	179.4	0	0	0	0	0	112.3	L207 F210 K211 F227 T228 A230 E236	L207-A232 HydrophobicContact CD1-CB 3.77Å; L207-A232 HydrophobicContact CG-CB 4.38Å; F210-A232 HydrophobicContact CD1-CB 4.41Å; F210-A232 WeakPolarHBondContact CE1-O 3.29Å; K211-A232 HydrophobicContact CD-CB 4.1Å; K211-A232 HydrophobicContact CG-CB 3.6Å; F227-A232 HydrophobicContact CB-CB 4.2Å; T228-A232 VanDerWaalsContact O-CB 3.25Å; T228-A232 WeakPolarHBondContact O-CB 3.45Å; T228-A232 PolarHBondContact O-N 2.92Å; A230-A232 VanDerWaalsContact C-N 3.3Å; A230-A232 PolarHBondContact O-N 2.91Å; A232-E236 WeakPolarHBondContact O-CB 3.25Å; A232-E236 PolarHBondContact O-N 3.2Å
233	K	84.1	Confident	77	Confident	114 Å²	114	38 Å²	38	50%	0.496	22%	0.215	S	C	.	.	H	α-helix	trans	-74.6	-36.5	177.1	-167.8	173.5	-175.7	176.6	0	111.9	S229 A230 E231 E236 N237	S229-K233 VanDerWaalsContact O-CB 3.28Å; S229-K233 WeakPolarHBondContact O-CB 3.44Å; S229-K233 PolarHBondContact O-N 2.84Å; A230-K233 PolarHBondContact O-N 2.91Å; A230-K233 VanDerWaalsContact O-N 3.11Å; E231-K233 PolarHBondContact O-N 3.24Å; K233-E236 PolarHBondContact O-N 3.45Å; K233-N237 WeakPolarHBondContact O-CB 3.47Å; K233-N237 VanDerWaalsContact O-CG 3.24Å; K233-N237 PolarHBondContact O-N 3.14Å; K233-N237 PolarHBondContact O-ND2 3.32Å
234	L	87.7	Confident	78.7	Confident	3 Å²	3	36.2 Å²	36.2	2%	0.016	20%	0.196	C	C	.	.	H	α-helix	trans	-64.2	-42.6	173.2	-175.1	56.2	0	0	0	111	A230 E231 N237 S238 L247 L249 I258	A230-L234 WeakPolarHBondContact O-CB 3.07Å; A230-L234 PolarHBondContact O-N 2.9Å; E231-L234 PolarHBondContact O-N 2.95Å; L234-N237 PolarHBondContact O-N 3.11Å; L234-S238 VanDerWaalsContact O-CB 3.28Å; L234-S238 WeakPolarHBondContact O-CB 3.35Å; L234-S238 PolarHBondContact O-N 3.33Å; L234-S238 PolarHBondContact O-OG 3.04Å; L234-L247 HydrophobicContact CD1-CB 4.29Å; L234-L247 HydrophobicContact CD1-CD2 4.02Å; L234-L247 HydrophobicContact CD2-CB 4.2Å; L234-L247 HydrophobicContact CG-CB 4.35Å; L234-L247 HydrophobicContact CG-CD2 4.46Å; L234-L249 HydrophobicContact CD2-CB 4.08Å; L234-L249 HydrophobicContact CD2-CD1 4.22Å; L234-L249 HydrophobicContact CD2-CD2 4.42Å; L234-L249 HydrophobicContact CD2-CG 4.48Å; L234-I258 HydrophobicContact CB-CD1 4.41Å; L234-I258 HydrophobicContact CD2-CD1 3.92Å; L234-I258 HydrophobicContact CG-CD1 4.29Å
235	L	84.8	Confident	80.4	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-58.4	-52.9	168.9	-88.3	171.1	0	0	0	111.9	F210 F227 E231 N237 S238 A239 I258 H261 L262	F210-L235 HydrophobicContact CE1-CB 3.8Å; F210-L235 HydrophobicContact CZ-CB 3.96Å; F227-L235 HydrophobicContact CD1-CD1 3.81Å; F227-L235 HydrophobicContact CD2-CD1 4.44Å; F227-L235 HydrophobicContact CE1-CD1 3.51Å; F227-L235 HydrophobicContact CE2-CD1 4.21Å; F227-L235 HydrophobicContact CG-CD1 4.26Å; F227-L235 HydrophobicContact CZ-CD1 3.75Å; E231-L235 VanDerWaalsContact O-CB 3.29Å; E231-L235 WeakPolarHBondContact O-CB 3.42Å; E231-L235 WeakPolarHBondContact O-CG 3.08Å; E231-L235 PolarHBondContact O-N 3.14Å; L235-N237 PolarHBondContact O-N 3.37Å; L235-S238 WeakPolarHBondContact CA-OG 3.41Å; L235-S238 PolarHBondContact O-N 2.72Å; L235-S238 PolarHBondContact O-OG 3.38Å; L235-A239 WeakPolarHBondContact O-CB 3.01Å; L235-A239 PolarHBondContact O-N 2.81Å; L235-I258 HydrophobicContact CD1-CG1 4.19Å; L235-I258 HydrophobicContact CD2-CB 4.43Å; L235-I258 HydrophobicContact CD2-CG2 3.75Å; L235-I258 HydrophobicContact CG-CB 4.44Å; L235-I258 HydrophobicContact CG-CD1 4.46Å; L235-I258 HydrophobicContact CG-CG1 4Å; L235-I258 HydrophobicContact CG-CG2 4.05Å; L235-H261 HydrophobicContact CD2-CB 4.42Å; L235-H261 VanDerWaalsContact CD2-CD2 3.48Å; L235-H261 WeakPolarHBondContact CD2-CD2 3.47Å; L235-L262 HydrophobicContact CD2-CD1 4.26Å; L235-L262 HydrophobicContact CD2-CD2 3.8Å; L235-L262 HydrophobicContact CD2-CG 3.8Å
236	E	80.3	Confident	81.7	Confident	30 Å²	30	33.6 Å²	33.6	14%	0.14	18%	0.178	C	C	.	.	H	α-helix	trans	-56.8	-36.6	-179.9	-158.7	-160.7	106.5	0	0	111.7	H206 F210 A232 K233 K240	H206-E236 VanDerWaalsContact CE1-CD 3.48Å; H206-E236 IonicContact CE1-OE1 3.82Å; H206-E236 IonicContact CE1-OE2 2.82Å; H206-E236 PolarHBondContact CE1-OE2 3.48Å; H206-E236 VanDerWaalsContact CE1-OE2 3.29Å; H206-E236 IonicContact ND1-OE1 3.73Å; H206-E236 IonicContact ND1-OE2 2.72Å; H206-E236 PolarHBondContact ND1-OE2 3.39Å; F210-E236 HydrophobicContact CD1-CB 4.17Å; F210-E236 HydrophobicContact CD1-CG 4.44Å; F210-E236 HydrophobicContact CD2-CB 4.33Å; F210-E236 HydrophobicContact CD2-CG 3.88Å; F210-E236 HydrophobicContact CE1-CB 3.87Å; F210-E236 HydrophobicContact CE1-CG 4.46Å; F210-E236 HydrophobicContact CE2-CB 4.03Å; F210-E236 HydrophobicContact CE2-CG 3.89Å; F210-E236 HydrophobicContact CG-CB 4.4Å; F210-E236 HydrophobicContact CG-CG 4.17Å; F210-E236 VanDerWaalsContact CZ-CA 3.44Å; F210-E236 HydrophobicContact CZ-CB 3.8Å; F210-E236 HydrophobicContact CZ-CG 4.2Å; A232-E236 WeakPolarHBondContact O-CB 3.25Å; A232-E236 PolarHBondContact O-N 3.2Å; K233-E236 PolarHBondContact O-N 3.45Å; E236-K240 VanDerWaalsContact O-CD 3.27Å; E236-K240 WeakPolarHBondContact O-CD 3.38Å; E236-K240 VanDerWaalsContact O-CE 3.23Å; E236-K240 WeakPolarHBondContact O-CE 3.18Å; E236-K240 WeakPolarHBondContact O-CG 3.2Å; E236-K240 WeakPolarHBondContact OE1-CE 3.29Å; E236-K240 IonicContact OE1-NZ 3.64Å; E236-K240 PolarHBondContact OE1-NZ 3.37Å
237	N	81.8	Confident	82.8	Confident	40 Å²	40	30 Å²	30	21%	0.214	16%	0.163	C	C	.	.	H	α-helix	trans	-75.6	-49.3	176.4	-70.7	-14.6	0	0	0	112.5	K233 L234 L235 A239 K240 Y416	K233-N237 WeakPolarHBondContact O-CB 3.47Å; K233-N237 VanDerWaalsContact O-CG 3.24Å; K233-N237 PolarHBondContact O-N 3.14Å; K233-N237 PolarHBondContact O-ND2 3.32Å; L234-N237 PolarHBondContact O-N 3.11Å; L235-N237 PolarHBondContact O-N 3.37Å; N237-A239 PolarHBondContact O-N 3.47Å; N237-A239 VanDerWaalsContact O-N 3.16Å; N237-K240 PolarHBondContact O-N 3.37Å; N237-K240 PolarHBondContact OD1-NZ 3.35Å; N237-K240 VanDerWaalsContact OD1-NZ 3.14Å; N237-Y416 HydrophobicContact CB-CD1 3.83Å; N237-Y416 HydrophobicContact CB-CE1 4.12Å; N237-Y416 HydrophobicContact CB-CG 4.36Å
238	S	82.8	Confident	83.6	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-57.5	-30.9	179.2	72.6	0	0	0	0	113.1	L234 L235 R395	L234-S238 VanDerWaalsContact O-CB 3.28Å; L234-S238 WeakPolarHBondContact O-CB 3.35Å; L234-S238 PolarHBondContact O-N 3.33Å; L234-S238 PolarHBondContact O-OG 3.04Å; L235-S238 WeakPolarHBondContact CA-OG 3.41Å; L235-S238 PolarHBondContact O-N 2.72Å; L235-S238 PolarHBondContact O-OG 3.38Å; S238-R395 VanDerWaalsContact O-CZ 3.28Å; S238-R395 PolarHBondContact O-NH1 3.33Å; S238-R395 PolarHBondContact O-NH2 2.84Å
239	A	74.9	Confident	84	Confident	6 Å²	6	29.2 Å²	29.2	5%	0.05	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	11.2	-172.6	0	0	0	0	0	114.3	L54 P55 L235 N237	L54-A239 WeakPolarHBondContact CD2-O 3.36Å; P55-A239 VanDerWaalsContact CD-CB 3.45Å; P55-A239 HydrophobicContact CG-CB 3.6Å; L235-A239 WeakPolarHBondContact O-CB 3.01Å; L235-A239 PolarHBondContact O-N 2.81Å; N237-A239 PolarHBondContact O-N 3.47Å; N237-A239 VanDerWaalsContact O-N 3.16Å
240	K	69.9	Low	84	Confident	111 Å²	111	33.9 Å²	33.9	48%	0.483	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-12.2	168.3	-84.4	161.3	-166.4	161	0	113.9	E236 N237	E236-K240 VanDerWaalsContact O-CD 3.27Å; E236-K240 WeakPolarHBondContact O-CD 3.38Å; E236-K240 VanDerWaalsContact O-CE 3.23Å; E236-K240 WeakPolarHBondContact O-CE 3.18Å; E236-K240 WeakPolarHBondContact O-CG 3.2Å; E236-K240 WeakPolarHBondContact OE1-CE 3.29Å; E236-K240 IonicContact OE1-NZ 3.64Å; E236-K240 PolarHBondContact OE1-NZ 3.37Å; N237-K240 PolarHBondContact O-N 3.37Å; N237-K240 PolarHBondContact OD1-NZ 3.35Å; N237-K240 VanDerWaalsContact OD1-NZ 3.14Å
241	G	70.2	Confident	83.8	Confident	17 Å²	17	32.8 Å²	32.8	18%	0.175	17%	0.169	C	C	.	.			trans	-141.3	167	-177.6	0	0	0	0	0	113.1	R395	G241-R395 PolarHBondContact O-NH1 3.13Å; G241-R395 VanDerWaalsContact O-NH1 3.13Å; G241-R395 PolarHBondContact O-NH2 2.91Å
242	D	75.3	Confident	83	Confident	76 Å²	76	35 Å²	35	41%	0.406	18%	0.178	S	C	.	.			trans	-86.8	-27.6	176.1	54.1	-9.4	0	0	0	113.6	I52 R395	I52-D242 HydrophobicContact CD1-CB 3.91Å; D242-R395 WeakPolarHBondContact O-CD 3.11Å; D242-R395 WeakPolarHBondContact O-CG 3.49Å; D242-R395 PolarHBondContact O-NE 3.3Å
243	Q	84.9	Confident	82.5	Confident	75 Å²	75	35 Å²	35	35%	0.35	18%	0.178	S	C	.	.	S	Bend	trans	-45.3	140.2	-178.7	-52.4	-57.2	-57.7	0	0	114.5	Q390 R395	Q243-Q390 VanDerWaalsContact CA-OE1 3.24Å; Q243-Q390 VanDerWaalsContact CD-OE1 3.29Å; Q243-R395 VanDerWaalsContact O-CZ 3.22Å; Q243-R395 PolarHBondContact O-NE 3Å; Q243-R395 PolarHBondContact O-NH2 3.43Å
244	D	92.2	Very high	82.3	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.011	16%	0.155	C	C	.	.			trans	-58.4	139.3	168.9	-53.4	-54.2	0	0	0	110.2	R384 R393 I396 F413 T414	D244-R384 IonicContact OD2-CZ 2.69Å; D244-R384 IonicContact OD2-NE 3.9Å; D244-R384 PolarHBondContact OD2-NE 2.92Å; D244-R384 IonicContact OD2-NH2 3.36Å; D244-R384 PolarHBondContact OD2-NH2 2.97Å; D244-R384 VanDerWaalsContact OD2-NH2 3.09Å; D244-R393 IonicContact OD1-CZ 3.29Å; D244-R393 IonicContact OD1-NH1 2.73Å; D244-R393 PolarHBondContact OD1-NH1 3.38Å; D244-R393 IonicContact OD1-NH2 3.61Å; D244-R393 IonicContact OD2-CZ 3.86Å; D244-R393 IonicContact OD2-NH1 2.75Å; D244-R393 PolarHBondContact OD2-NH1 3.33Å; D244-R393 IonicContact OD2-NH2 3.71Å; D244-R393 PolarHBondContact OD2-NH2 3.3Å; D244-I396 VanDerWaalsContact CA-O 3.25Å; D244-I396 WeakPolarHBondContact CA-O 3.38Å; D244-I396 HydrophobicContact CB-CB 4.31Å; D244-I396 WeakPolarHBondContact CB-O 3.49Å; D244-I396 PolarHBondContact OD1-N 2.82Å; D244-F413 HydrophobicContact CB-CB 4.5Å; D244-F413 HydrophobicContact CB-CD1 4.15Å; D244-F413 HydrophobicContact CB-CD2 3.58Å; D244-F413 HydrophobicContact CB-CE1 4.28Å; D244-F413 HydrophobicContact CB-CE2 3.72Å; D244-F413 HydrophobicContact CB-CG 3.8Å; D244-F413 HydrophobicContact CB-CZ 4.07Å; D244-T414 PolarHBondContact O-N 2.85Å
245	C	93.2	Very high	82.3	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	152.9	-171.1	64.5	0	0	0	0	114.6	R395 I396 C398 T414 Y416	C245-R395 PolarHBondContact SG-NH2 2.88Å; C245-I396 PolarHBondContact N-O 3.41Å; C245-C398 PolarHBondContact O-N 3.44Å; C245-T414 CarbonylContact C-O 3.54Å; C245-T414 WeakPolarHBondContact CA-O 3.32Å; C245-T414 WeakPolarHBondContact CB-O 3.31Å; C245-Y416 HydrophobicContact CB-CD2 3.86Å; C245-Y416 HydrophobicContact CB-CE2 3.69Å
246	V	94.4	Very high	82.2	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126	169.3	-176.4	0	0	0	0	108	L248 V367 C398 V404 F410 F413 T414 Q415 Y416	V246-L248 HydrophobicContact CG1-CD2 3.98Å; V246-V367 HydrophobicContact CG1-CG2 4.19Å; V246-C398 CarbonylContact C-O 3.58Å; V246-C398 WeakPolarHBondContact CA-O 3.23Å; V246-C398 HydrophobicContact CG2-CB 4.27Å; V246-V404 HydrophobicContact CB-CG2 4.45Å; V246-V404 HydrophobicContact CG1-CG2 3.99Å; V246-V404 HydrophobicContact CG2-CG2 4.01Å; V246-F410 HydrophobicContact CG2-CB 4.33Å; V246-F413 HydrophobicContact CG2-CB 3.91Å; V246-F413 HydrophobicContact CG2-CD2 4.2Å; V246-F413 HydrophobicContact CG2-CG 4.41Å; V246-T414 PolarHBondContact N-O 2.71Å; V246-Q415 HydrophobicContact CB-CG 4.33Å; V246-Q415 WeakPolarHBondContact O-CA 3.43Å; V246-Y416 PolarHBondContact O-N 2.86Å
247	L	93.5	Very high	82.1	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	107.4	179.9	-53.2	-173.1	0	0	0	108.5	L234 L249 I258 L262 I397 C398 F399 G400 Y416	L234-L247 HydrophobicContact CD1-CB 4.29Å; L234-L247 HydrophobicContact CD1-CD2 4.02Å; L234-L247 HydrophobicContact CD2-CB 4.2Å; L234-L247 HydrophobicContact CG-CB 4.35Å; L234-L247 HydrophobicContact CG-CD2 4.46Å; L247-L249 PolarHBondContact O-N 2.87Å; L247-I258 HydrophobicContact CD1-CG2 3.85Å; L247-L262 HydrophobicContact CD1-CD1 3.81Å; L247-I397 HydrophobicContact CD1-CG2 3.86Å; L247-I397 HydrophobicContact CG-CG2 4.21Å; L247-C398 PolarHBondContact N-O 2.79Å; L247-F399 HydrophobicContact CB-CD1 3.79Å; L247-F399 HydrophobicContact CB-CE1 3.99Å; L247-F399 HydrophobicContact CD1-CD1 4.46Å; L247-F399 HydrophobicContact CD1-CE1 3.86Å; L247-F399 HydrophobicContact CD1-CZ 4.14Å; L247-F399 HydrophobicContact CG-CE1 4.5Å; L247-F399 WeakPolarHBondContact O-CA 3.11Å; L247-G400 PolarHBondContact O-N 3.16Å; L247-Y416 HydrophobicContact CD2-CD2 3.87Å; L247-Y416 HydrophobicContact CD2-CG 4.47Å
248	L	92.9	Very high	82.3	Confident	31 Å²	31	26.7 Å²	26.7	16%	0.162	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	111.2	-179.8	-55.8	-179.9	0	0	0	108.5	V246 M402 K403 Y416	V246-L248 HydrophobicContact CG1-CD2 3.98Å; L248-M402 WeakPolarHBondContact CD2-O 3.35Å; L248-K403 HydrophobicContact CD1-CG 3.76Å; L248-Y416 WeakPolarHBondContact CB-O 3.09Å; L248-Y416 WeakPolarHBondContact CG-O 3.47Å; L248-Y416 PolarHBondContact N-O 3.04Å
249	L	89.1	Confident	82.6	Confident	21 Å²	21	26.7 Å²	26.7	11%	0.11	14%	0.14	C	C	.	.			trans	-154.3	113.5	-177.7	-168.1	66.8	0	0	0	111.2	E231 L234 L247 G254 R255 I258 G400	E231-L249 HydrophobicContact CG-CD2 4.38Å; L234-L249 HydrophobicContact CD2-CB 4.08Å; L234-L249 HydrophobicContact CD2-CD1 4.22Å; L234-L249 HydrophobicContact CD2-CD2 4.42Å; L234-L249 HydrophobicContact CD2-CG 4.48Å; L247-L249 PolarHBondContact O-N 2.87Å; L249-G254 VanDerWaalsContact CD2-C 3.49Å; L249-R255 HydrophobicContact CB-CG 4.43Å; L249-R255 HydrophobicContact CD2-CG 4.17Å; L249-R255 PolarHBondContact O-NE 2.94Å; L249-R255 PolarHBondContact O-NH2 3.27Å; L249-R255 VanDerWaalsContact O-NH2 3.11Å; L249-I258 HydrophobicContact CD2-CD1 3.84Å; L249-G400 CarbonylContact C-O 3.49Å; L249-G400 PolarHBondContact N-O 3.37Å
250	D	80.2	Confident	82.9	Confident	119 Å²	119	26.4 Å²	26.4	64%	0.636	14%	0.138	S	C	*	.			trans	-71.7	-30.6	176.8	-59.1	-43.1	0	0	0	112.8	F252	D250-F252 PolarHBondContact O-N 3.09Å
251	S	77.9	Confident	83.5	Confident	39 Å²	39	21.2 Å²	21.2	27%	0.273	12%	0.115	S	C	.	.			trans	-71.2	102.7	178.1	-176.7	0	0	0	0	110.7	D253 G254 R255	S251-D253 PolarHBondContact O-N 3.25Å; S251-G254 WeakPolarHBondContact O-CA 3.33Å; S251-G254 PolarHBondContact O-N 3.2Å; S251-G254 PolarHBondContact OG-N 3.38Å; S251-R255 PolarHBondContact O-N 3.19Å
252	F	70.5	Confident	84.2	Confident	48 Å²	48	20.7 Å²	20.7	21%	0.211	11%	0.108	C	C	.	.	H	α-helix	trans	-51.1	-53.8	174.7	-172.5	-92.1	0	0	0	111.5	M173 K176 D250 G254 R255 H365	M173-F252 HydrophobicContact CE-CE1 3.6Å; M173-F252 HydrophobicContact CE-CZ 3.49Å; M173-F252 VanDerWaalsContact CE-CZ 3.49Å; K176-F252 HydrophobicContact CB-CD1 4Å; K176-F252 HydrophobicContact CB-CE1 3.85Å; K176-F252 HydrophobicContact CD-CD1 3.99Å; K176-F252 HydrophobicContact CD-CD2 4.41Å; K176-F252 HydrophobicContact CD-CE1 3.34Å; K176-F252 HydrophobicContact CD-CE2 3.83Å; K176-F252 HydrophobicContact CD-CG 4.49Å; K176-F252 HydrophobicContact CD-CZ 3.27Å; K176-F252 HydrophobicContact CG-CE1 4.27Å; K176-F252 VanDerWaalsContact NZ-CE2 3.33Å; D250-F252 PolarHBondContact O-N 3.09Å; F252-G254 PolarHBondContact O-N 3.02Å; F252-G254 VanDerWaalsContact O-N 3.14Å; F252-R255 WeakPolarHBondContact O-CB 3.32Å; F252-R255 PolarHBondContact O-N 3.09Å; F252-H365 AromaticContact CD2-NE2 3.71Å; F252-H365 AromaticContact CE2-CE1 3.76Å; F252-H365 AromaticContact CE2-NE2 3.01Å; F252-H365 WeakPolarHBondContact CE2-NE2 3.46Å; F252-H365 AromaticContact CZ-CE1 3.79Å; F252-H365 AromaticContact CZ-NE2 3.41Å; F252-H365 WeakPolarHBondContact CZ-NE2 3.44Å
253	D	71.6	Confident	84.7	Confident	2 Å²	2	17.1 Å²	17.1	1%	0.011	9%	0.089	C	C	.	.	H	α-helix	trans	-58.6	-28.4	177.2	-57.6	-9.2	0	0	0	113.2	H177 S180 S251 R257	H177-D253 WeakPolarHBondContact CA-OD1 3.35Å; H177-D253 IonicContact CE1-OD2 2.65Å; H177-D253 IonicContact CG-OD2 3.47Å; H177-D253 IonicContact ND1-OD1 3.8Å; H177-D253 IonicContact ND1-OD2 3.34Å; H177-D253 PolarHBondContact ND1-OD2 3.15Å; S180-D253 VanDerWaalsContact CB-OD2 3.24Å; S180-D253 WeakPolarHBondContact CB-OD2 3.37Å; S180-D253 PolarHBondContact OG-OD2 3.4Å; S251-D253 PolarHBondContact O-N 3.25Å; D253-R257 WeakPolarHBondContact O-CG 3.48Å; D253-R257 PolarHBondContact O-NH1 3.11Å
254	G	81.3	Confident	84.5	Confident	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-72.1	-33.4	176.3	0	0	0	0	0	112.8	L249 S251 F252 D256 R257 I258	L249-G254 VanDerWaalsContact CD2-C 3.49Å; S251-G254 WeakPolarHBondContact O-CA 3.33Å; S251-G254 PolarHBondContact O-N 3.2Å; S251-G254 PolarHBondContact OG-N 3.38Å; F252-G254 PolarHBondContact O-N 3.02Å; F252-G254 VanDerWaalsContact O-N 3.14Å; G254-D256 VanDerWaalsContact C-N 3.34Å; G254-D256 PolarHBondContact O-N 3.34Å; G254-R257 PolarHBondContact O-N 3.02Å; G254-I258 WeakPolarHBondContact O-CG1 3.34Å; G254-I258 PolarHBondContact O-N 3.48Å; G254-I258 VanDerWaalsContact O-N 3.1Å
255	R	86.9	Confident	83.9	Confident	5 Å²	5	14.9 Å²	14.9	2%	0.019	8%	0.082	C	C	.	.	H	α-helix	trans	-60.8	-45	178.9	-62.1	-177.2	177.4	-175.2	5.3	111.1	L249 S251 F252 R257 I258 A259 H365 D366 F399 G400	L249-R255 HydrophobicContact CB-CG 4.43Å; L249-R255 HydrophobicContact CD2-CG 4.17Å; L249-R255 PolarHBondContact O-NE 2.94Å; L249-R255 PolarHBondContact O-NH2 3.27Å; L249-R255 VanDerWaalsContact O-NH2 3.11Å; S251-R255 PolarHBondContact O-N 3.19Å; F252-R255 WeakPolarHBondContact O-CB 3.32Å; F252-R255 PolarHBondContact O-N 3.09Å; R255-R257 PolarHBondContact O-N 3.43Å; R255-I258 PolarHBondContact O-N 3.01Å; R255-A259 WeakPolarHBondContact O-CB 3.42Å; R255-A259 PolarHBondContact O-N 2.6Å; R255-H365 PolarHBondContact NH1-O 3.42Å; R255-D366 IonicContact CZ-OD2 3.14Å; R255-D366 IonicContact NH1-OD2 3.07Å; R255-D366 PolarHBondContact NH1-OD2 2.66Å; R255-D366 IonicContact NH2-OD2 2.99Å; R255-F399 HydrophobicContact CB-CD1 3.91Å; R255-F399 HydrophobicContact CB-CD2 4.48Å; R255-F399 HydrophobicContact CB-CE1 4.09Å; R255-F399 HydrophobicContact CB-CG 4.1Å; R255-F399 HydrophobicContact CB-CZ 4.45Å; R255-F399 HydrophobicContact CG-CB 4.11Å; R255-F399 HydrophobicContact CG-CD1 3.7Å; R255-F399 HydrophobicContact CG-CE1 4.29Å; R255-F399 HydrophobicContact CG-CG 3.97Å; R255-F399 WeakPolarHBondContact O-CZ 3.36Å; R255-G400 PolarHBondContact NH2-O 3.42Å; R255-G400 VanDerWaalsContact NH2-O 3.09Å
256	D	81.8	Confident	83.3	Confident	7 Å²	7	15.3 Å²	15.3	4%	0.037	8%	0.084	C	C	.	.	H	α-helix	trans	-67.7	-38.5	-177.6	-56.5	-38.7	0	0	0	112.1	M173 G254 I258 A259 I260 W289 H365	M173-D256 VanDerWaalsContact CE-CG 3.42Å; M173-D256 WeakPolarHBondContact CE-OD1 3.24Å; M173-D256 WeakPolarHBondContact CE-OD2 3.2Å; G254-D256 VanDerWaalsContact C-N 3.34Å; G254-D256 PolarHBondContact O-N 3.34Å; D256-I258 VanDerWaalsContact C-N 3.32Å; D256-I258 PolarHBondContact O-N 3.25Å; D256-A259 PolarHBondContact O-N 3.13Å; D256-I260 VanDerWaalsContact O-CG2 3.29Å; D256-I260 WeakPolarHBondContact O-CG2 3.45Å; D256-I260 PolarHBondContact O-N 2.83Å; D256-W289 HydrophobicContact CB-CH2 4.24Å; D256-W289 HydrophobicContact CB-CZ2 4.45Å; D256-W289 WeakPolarHBondContact OD1-CZ2 3.41Å; D256-H365 IonicContact OD1-CE1 3.29Å; D256-H365 PolarHBondContact OD1-CE1 3.34Å; D256-H365 IonicContact OD1-ND1 2.77Å; D256-H365 PolarHBondContact OD1-ND1 2.82Å; D256-H365 VanDerWaalsContact OD1-ND1 3.14Å
257	R	80.1	Confident	82.6	Confident	1 Å²	1	16.4 Å²	16.4	0%	0.004	9%	0.09	C	C	.	.	H	α-helix	trans	-60.7	-42.7	174.7	-65	-173.3	-63.9	-109.2	23.2	111.4	F167 E182 I225 K226 F227 E231 D253 G254 R255 H261	F167-R257 VanDerWaalsContact CE2-NH1 3.34Å; E182-R257 IonicContact OE1-NH2 2.7Å; E182-R257 PolarHBondContact OE1-NH2 3.24Å; E182-R257 IonicContact OE2-CZ 3.63Å; E182-R257 IonicContact OE2-NH1 3.6Å; E182-R257 PolarHBondContact OE2-NH1 2.86Å; E182-R257 IonicContact OE2-NH2 2.73Å; E182-R257 PolarHBondContact OE2-NH2 2.98Å; I225-R257 HydrophobicContact CD1-CB 3.87Å; I225-R257 HydrophobicContact CD1-CG 3.99Å; I225-R257 HydrophobicContact CG1-CB 4.28Å; I225-R257 HydrophobicContact CG1-CG 4.03Å; K226-R257 WeakPolarHBondContact O-CD 3.41Å; F227-R257 HydrophobicContact CD1-CB 4.21Å; F227-R257 HydrophobicContact CE1-CB 3.75Å; F227-R257 WeakPolarHBondContact CE1-O 3.48Å; E231-R257 IonicContact OE1-CZ 3.38Å; E231-R257 IonicContact OE1-NE 2.96Å; E231-R257 IonicContact OE1-NH2 3.16Å; E231-R257 PolarHBondContact OE1-NH2 2.84Å; E231-R257 IonicContact OE2-CZ 3.62Å; E231-R257 IonicContact OE2-NE 3.24Å; E231-R257 PolarHBondContact OE2-NE 3.41Å; E231-R257 IonicContact OE2-NH2 3.81Å; E231-R257 PolarHBondContact OE2-NH2 3.09Å; E231-R257 VanDerWaalsContact OE2-NH2 3.16Å; D253-R257 WeakPolarHBondContact O-CG 3.48Å; D253-R257 PolarHBondContact O-NH1 3.11Å; G254-R257 PolarHBondContact O-N 3.02Å; R255-R257 PolarHBondContact O-N 3.43Å; R257-H261 WeakPolarHBondContact O-CB 3.42Å; R257-H261 PolarHBondContact O-N 3.31Å
258	I	85.5	Confident	81.6	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-71.1	-44.2	177	-66.4	-177	0	0	0	110.8	F227 E231 L234 L235 L247 L249 G254 R255 D256 H261 L262 F399	F227-I258 HydrophobicContact CE1-CG1 4.49Å; E231-I258 HydrophobicContact CB-CD1 3.97Å; E231-I258 HydrophobicContact CB-CG1 4.18Å; E231-I258 HydrophobicContact CG-CD1 3.98Å; E231-I258 HydrophobicContact CG-CG1 4.24Å; L234-I258 HydrophobicContact CB-CD1 4.41Å; L234-I258 HydrophobicContact CD2-CD1 3.92Å; L234-I258 HydrophobicContact CG-CD1 4.29Å; L235-I258 HydrophobicContact CD1-CG1 4.19Å; L235-I258 HydrophobicContact CD2-CB 4.43Å; L235-I258 HydrophobicContact CD2-CG2 3.75Å; L235-I258 HydrophobicContact CG-CB 4.44Å; L235-I258 HydrophobicContact CG-CD1 4.46Å; L235-I258 HydrophobicContact CG-CG1 4Å; L235-I258 HydrophobicContact CG-CG2 4.05Å; L247-I258 HydrophobicContact CD1-CG2 3.85Å; L249-I258 HydrophobicContact CD2-CD1 3.84Å; G254-I258 WeakPolarHBondContact O-CG1 3.34Å; G254-I258 PolarHBondContact O-N 3.48Å; G254-I258 VanDerWaalsContact O-N 3.1Å; R255-I258 PolarHBondContact O-N 3.01Å; D256-I258 VanDerWaalsContact C-N 3.32Å; D256-I258 PolarHBondContact O-N 3.25Å; I258-H261 WeakPolarHBondContact O-CB 3.47Å; I258-H261 PolarHBondContact O-N 3.13Å; I258-L262 HydrophobicContact CG2-CD1 3.59Å; I258-L262 HydrophobicContact CG2-CG 4.23Å; I258-L262 WeakPolarHBondContact O-CG 3.43Å; I258-L262 PolarHBondContact O-N 3.13Å; I258-F399 HydrophobicContact CB-CE1 3.94Å; I258-F399 HydrophobicContact CB-CZ 3.98Å; I258-F399 HydrophobicContact CG2-CE1 3.73Å; I258-F399 HydrophobicContact CG2-CZ 3.7Å
259	A	88	Confident	80.6	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-62.5	-48.1	-177.3	0	0	0	0	0	112.7	R255 D256 H261 L262 A263 W289 I363 F399	R255-A259 WeakPolarHBondContact O-CB 3.42Å; R255-A259 PolarHBondContact O-N 2.6Å; D256-A259 PolarHBondContact O-N 3.13Å; A259-H261 VanDerWaalsContact C-N 3.28Å; A259-H261 PolarHBondContact O-N 3.41Å; A259-L262 PolarHBondContact O-N 2.61Å; A259-A263 WeakPolarHBondContact O-CB 3.33Å; A259-A263 PolarHBondContact O-N 2.73Å; A259-W289 HydrophobicContact CB-CD2 4.18Å; A259-W289 HydrophobicContact CB-CE3 4.23Å; A259-W289 HydrophobicContact CB-CH2 3.42Å; A259-W289 VanDerWaalsContact CB-CH2 3.42Å; A259-W289 HydrophobicContact CB-CZ2 3.27Å; A259-W289 HydrophobicContact CB-CZ3 3.89Å; A259-I363 HydrophobicContact CB-CG2 3.97Å; A259-I363 WeakPolarHBondContact O-CD1 3.46Å; A259-F399 HydrophobicContact CB-CE2 3.84Å; A259-F399 HydrophobicContact CB-CZ 3.97Å
260	I	81	Confident	79.6	Confident	1 Å²	1	17.5 Å²	17.5	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-66.7	-31	177.9	-166	57.1	0	0	0	112.1	F170 L218 V221 Y222 I225 D256 N264 W289 L320 L337	F170-I260 HydrophobicContact CZ-CD1 4.31Å; L218-I260 HydrophobicContact CD2-CG2 4.38Å; V221-I260 HydrophobicContact CG1-CD1 4.19Å; V221-I260 HydrophobicContact CG1-CG1 4.07Å; Y222-I260 HydrophobicContact CD2-CG2 4.04Å; Y222-I260 HydrophobicContact CE2-CG2 4.38Å; I225-I260 HydrophobicContact CD1-CG2 4.08Å; D256-I260 VanDerWaalsContact O-CG2 3.29Å; D256-I260 WeakPolarHBondContact O-CG2 3.45Å; D256-I260 PolarHBondContact O-N 2.83Å; I260-N264 PolarHBondContact O-N 3.31Å; I260-N264 VanDerWaalsContact O-N 3.12Å; I260-W289 HydrophobicContact CB-CZ3 4.11Å; I260-W289 HydrophobicContact CD1-CZ3 4.37Å; I260-L320 HydrophobicContact CD1-CD2 4.06Å; I260-L337 HydrophobicContact CD1-CD2 3.82Å
261	H	82.5	Confident	79	Confident	1 Å²	1	16.7 Å²	16.7	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-65.4	-50.7	172.1	-175.7	72.2	0	0	0	111.8	C214 L218 F227 L235 R257 I258 A259 A263 N264 A265	C214-H261 VanDerWaalsContact CA-CE1 3.49Å; C214-H261 WeakPolarHBondContact CA-CE1 3.22Å; C214-H261 PolarHBondContact O-ND1 2.78Å; L218-H261 HydrophobicContact CD1-CB 3.85Å; L218-H261 HydrophobicContact CG-CB 4.38Å; F227-H261 HydrophobicContact CZ-CB 4.03Å; L235-H261 HydrophobicContact CD2-CB 4.42Å; L235-H261 VanDerWaalsContact CD2-CD2 3.48Å; L235-H261 WeakPolarHBondContact CD2-CD2 3.47Å; R257-H261 WeakPolarHBondContact O-CB 3.42Å; R257-H261 PolarHBondContact O-N 3.31Å; I258-H261 WeakPolarHBondContact O-CB 3.47Å; I258-H261 PolarHBondContact O-N 3.13Å; A259-H261 VanDerWaalsContact C-N 3.28Å; A259-H261 PolarHBondContact O-N 3.41Å; H261-A263 PolarHBondContact O-N 3.32Å; H261-N264 PolarHBondContact O-N 3.28Å; H261-A265 WeakPolarHBondContact O-CB 3.42Å; H261-A265 PolarHBondContact O-N 3.24Å
262	L	86.1	Confident	78.2	Confident	6 Å²	6	18.3 Å²	18.3	3%	0.031	9%	0.092	C	C	.	.	H	α-helix	trans	-65.7	-38	-179.6	-68.8	172.5	0	0	0	111.6	L235 L247 I258 A259 A265 L266 I363 I397	L235-L262 HydrophobicContact CD2-CD1 4.26Å; L235-L262 HydrophobicContact CD2-CD2 3.8Å; L235-L262 HydrophobicContact CD2-CG 3.8Å; L247-L262 HydrophobicContact CD1-CD1 3.81Å; I258-L262 HydrophobicContact CG2-CD1 3.59Å; I258-L262 HydrophobicContact CG2-CG 4.23Å; I258-L262 WeakPolarHBondContact O-CG 3.43Å; I258-L262 PolarHBondContact O-N 3.13Å; A259-L262 PolarHBondContact O-N 2.61Å; L262-A265 PolarHBondContact O-N 3.37Å; L262-L266 WeakPolarHBondContact O-CB 3.33Å; L262-L266 WeakPolarHBondContact O-CD1 3.48Å; L262-L266 VanDerWaalsContact O-CG 3.24Å; L262-L266 WeakPolarHBondContact O-CG 3.24Å; L262-L266 PolarHBondContact O-N 3.17Å; L262-I363 HydrophobicContact CB-CD1 4.39Å; L262-I397 HydrophobicContact CB-CD1 4.31Å; L262-I397 HydrophobicContact CD1-CD1 4.11Å; L262-I397 HydrophobicContact CD1-CG2 3.99Å
263	A	86.4	Confident	77.5	Confident	1 Å²	1	18.3 Å²	18.3	1%	0.008	9%	0.094	C	C	.	.	H	α-helix	trans	-58	-51.1	172.4	0	0	0	0	0	111.5	A259 H261 A265 L266 L267 V287 L337 I363	A259-A263 WeakPolarHBondContact O-CB 3.33Å; A259-A263 PolarHBondContact O-N 2.73Å; H261-A263 PolarHBondContact O-N 3.32Å; A263-A265 PolarHBondContact O-N 3.08Å; A263-L266 PolarHBondContact O-N 3.38Å; A263-L267 WeakPolarHBondContact O-CG 3.16Å; A263-L267 PolarHBondContact O-N 3.01Å; A263-V287 HydrophobicContact CB-CB 4.31Å; A263-V287 HydrophobicContact CB-CG1 3.9Å; A263-V287 HydrophobicContact CB-CG2 4.5Å; A263-L337 HydrophobicContact CB-CD1 4.32Å; A263-I363 HydrophobicContact CB-CD1 3.85Å
264	N	79.9	Confident	76.5	Confident	15 Å²	15	19.5 Å²	19.5	8%	0.08	10%	0.102	C	C	.	.	H	α-helix	trans	-69.3	-34.7	-178.9	-152.9	43.4	0	0	0	112.4	V217 L218 I260 H261 L267 I268	V217-N264 PolarHBondContact O-ND2 2.96Å; L218-N264 HydrophobicContact CD2-CB 4.5Å; I260-N264 PolarHBondContact O-N 3.31Å; I260-N264 VanDerWaalsContact O-N 3.12Å; H261-N264 PolarHBondContact O-N 3.28Å; N264-L267 PolarHBondContact O-N 2.92Å; N264-I268 WeakPolarHBondContact O-CB 3.29Å; N264-I268 WeakPolarHBondContact O-CD1 3.47Å; N264-I268 VanDerWaalsContact O-CG1 3.26Å; N264-I268 WeakPolarHBondContact O-CG1 3.44Å; N264-I268 PolarHBondContact O-N 2.88Å
265	A	79.3	Confident	75.1	Confident	15 Å²	15	24.3 Å²	24.3	12%	0.124	13%	0.132	C	C	.	.	H	α-helix	trans	-63.3	-42.8	174.4	0	0	0	0	0	112.3	V217 H261 L262 A263 A269	V217-A265 HydrophobicContact CG1-CB 4.37Å; H261-A265 WeakPolarHBondContact O-CB 3.42Å; H261-A265 PolarHBondContact O-N 3.24Å; L262-A265 PolarHBondContact O-N 3.37Å; A263-A265 PolarHBondContact O-N 3.08Å; A265-A269 WeakPolarHBondContact O-CB 3.38Å; A265-A269 PolarHBondContact O-N 2.73Å
266	L	80.4	Confident	73.4	Confident	10 Å²	10	30.6 Å²	30.6	5%	0.052	16%	0.164	C	C	.	.	H	α-helix	trans	-63.6	-42	174.7	-72.8	165.9	0	0	0	111.8	I52 L262 A263 A269 N270 V287 I397	I52-L266 HydrophobicContact CG1-CD2 4.29Å; L262-L266 WeakPolarHBondContact O-CB 3.33Å; L262-L266 WeakPolarHBondContact O-CD1 3.48Å; L262-L266 VanDerWaalsContact O-CG 3.24Å; L262-L266 WeakPolarHBondContact O-CG 3.24Å; L262-L266 PolarHBondContact O-N 3.17Å; A263-L266 PolarHBondContact O-N 3.38Å; L266-A269 PolarHBondContact O-N 3.16Å; L266-N270 PolarHBondContact O-N 2.96Å; L266-N270 PolarHBondContact O-ND2 3.3Å; L266-V287 HydrophobicContact CB-CG2 3.92Å; L266-V287 HydrophobicContact CD1-CG2 4.28Å; L266-I397 HydrophobicContact CD1-CD1 4.21Å
267	L	79.4	Confident	71.9	Confident	22 Å²	22	34.4 Å²	34.4	12%	0.115	19%	0.185	C	C	.	.	H	α-helix	trans	-65.2	-44.6	177.2	-71.7	164.4	0	0	0	112.4	A263 N264 N270 K271 T285 V287 L320 D336	A263-L267 WeakPolarHBondContact O-CG 3.16Å; A263-L267 PolarHBondContact O-N 3.01Å; N264-L267 PolarHBondContact O-N 2.92Å; L267-N270 PolarHBondContact O-N 3.37Å; L267-K271 PolarHBondContact O-N 3.07Å; L267-T285 VanDerWaalsContact CD2-O 3.28Å; L267-T285 WeakPolarHBondContact CD2-O 3.38Å; L267-V287 HydrophobicContact CD1-CG2 4.48Å; L267-V287 HydrophobicContact CD2-CG2 4.34Å; L267-V287 HydrophobicContact CG-CG2 3.98Å; L267-L320 HydrophobicContact CD1-CD1 3.54Å; L267-D336 HydrophobicContact CD1-CB 4.1Å; L267-D336 HydrophobicContact CD2-CB 4.38Å; L267-D336 WeakPolarHBondContact CD2-O 3.22Å
268	I	73.6	Confident	70.4	Confident	57 Å²	57	39.8 Å²	39.8	29%	0.292	22%	0.22	S	C	.	.	H	α-helix	trans	-63.1	-43.2	176.2	-71	164.4	0	0	0	110.9	V217 N264 N270 K271 N272	V217-I268 HydrophobicContact CG1-CD1 4.18Å; N264-I268 WeakPolarHBondContact O-CB 3.29Å; N264-I268 WeakPolarHBondContact O-CD1 3.47Å; N264-I268 VanDerWaalsContact O-CG1 3.26Å; N264-I268 WeakPolarHBondContact O-CG1 3.44Å; N264-I268 PolarHBondContact O-N 2.88Å; I268-N270 VanDerWaalsContact C-N 3.28Å; I268-N270 PolarHBondContact O-N 2.84Å; I268-K271 PolarHBondContact O-N 2.81Å; I268-N272 VanDerWaalsContact O-CG 3.23Å; I268-N272 PolarHBondContact O-N 3.22Å; I268-N272 VanDerWaalsContact O-N 3.08Å; I268-N272 PolarHBondContact O-ND2 3.05Å; I268-N272 PolarHBondContact O-OD1 2.9Å
269	A	71	Confident	68.8	Low	1 Å²	1	44.2 Å²	44.2	1%	0.008	25%	0.251	C	S	.	.	H	α-helix	trans	-55.6	-43.6	176.8	0	0	0	0	0	112.4	S53 A265 L266 N272 L273	S53-A269 VanDerWaalsContact N-CB 3.33Å; S53-A269 WeakPolarHBondContact OG-CA 3.43Å; A265-A269 WeakPolarHBondContact O-CB 3.38Å; A265-A269 PolarHBondContact O-N 2.73Å; L266-A269 PolarHBondContact O-N 3.16Å; A269-N272 PolarHBondContact O-N 2.82Å; A269-L273 PolarHBondContact O-N 2.99Å
270	N	69	Low	66.8	Low	17 Å²	17	46 Å²	46	9%	0.091	26%	0.263	C	S	.	.	H	α-helix	trans	-71.8	-41.3	179.4	-78.7	-85.9	0	0	0	112.7	L50 L266 L267 I268 N272 L273 S274 T285 C360	L50-N270 WeakPolarHBondContact CD2-OD1 3.32Å; L266-N270 PolarHBondContact O-N 2.96Å; L266-N270 PolarHBondContact O-ND2 3.3Å; L267-N270 PolarHBondContact O-N 3.37Å; I268-N270 VanDerWaalsContact C-N 3.28Å; I268-N270 PolarHBondContact O-N 2.84Å; N270-N272 PolarHBondContact O-N 2.96Å; N270-L273 WeakPolarHBondContact O-CB 3.22Å; N270-L273 PolarHBondContact O-N 3.46Å; N270-L273 VanDerWaalsContact O-N 3.09Å; N270-S274 PolarHBondContact O-N 3.31Å; N270-S274 PolarHBondContact O-OG 3.37Å; N270-S274 VanDerWaalsContact O-OG 3.09Å; N270-T285 WeakPolarHBondContact CB-OG1 3.31Å; N270-T285 PolarHBondContact OD1-OG1 3.08Å; N270-C360 WeakPolarHBondContact ND2-CB 3.48Å
271	K	67.7	Low	65	Low	103 Å²	103	52 Å²	52	45%	0.448	30%	0.303	S	S	.	.	H	α-helix	trans	-57.5	-36	174.5	-171.3	-169.6	174.7	-165.2	0	112.1	L267 I268 S274 T275 T315	L267-K271 PolarHBondContact O-N 3.07Å; I268-K271 PolarHBondContact O-N 2.81Å; K271-S274 VanDerWaalsContact O-CB 3.31Å; K271-S274 WeakPolarHBondContact O-CB 3.47Å; K271-S274 PolarHBondContact O-N 3.47Å; K271-S274 PolarHBondContact O-OG 2.73Å; K271-T275 PolarHBondContact O-N 3.37Å; K271-T315 PolarHBondContact NZ-O 3.09Å
272	N	59.5	Low	63.3	Low	72 Å²	72	54.2 Å²	54.2	39%	0.385	32%	0.318	S	S	.	.	H	α-helix	trans	-70.6	-31.8	178.6	-66.1	-15.3	0	0	0	112.6	I268 A269 N270 T275 I276	I268-N272 VanDerWaalsContact O-CG 3.23Å; I268-N272 PolarHBondContact O-N 3.22Å; I268-N272 VanDerWaalsContact O-N 3.08Å; I268-N272 PolarHBondContact O-ND2 3.05Å; I268-N272 PolarHBondContact O-OD1 2.9Å; A269-N272 PolarHBondContact O-N 2.82Å; N270-N272 PolarHBondContact O-N 2.96Å; N272-T275 WeakPolarHBondContact CA-OG1 3.15Å; N272-T275 PolarHBondContact O-N 2.95Å; N272-T275 PolarHBondContact O-OG1 2.97Å; N272-I276 WeakPolarHBondContact O-CD1 3.4Å; N272-I276 WeakPolarHBondContact O-CG1 3.15Å
273	L	55.7	Low	61.5	Low	49 Å²	49	56.5 Å²	56.5	26%	0.257	33%	0.332	S	S	.	.	H	α-helix	trans	-65.3	-43.1	171.6	-79.2	156.4	0	0	0	111.1	K51 A269 N270 T275 I276 D277	K51-L273 HydrophobicContact CB-CD1 4.28Å; K51-L273 HydrophobicContact CB-CD2 4.17Å; K51-L273 HydrophobicContact CD-CD2 4.46Å; K51-L273 HydrophobicContact CG-CD2 4.45Å; A269-L273 PolarHBondContact O-N 2.99Å; N270-L273 WeakPolarHBondContact O-CB 3.22Å; N270-L273 PolarHBondContact O-N 3.46Å; N270-L273 VanDerWaalsContact O-N 3.09Å; L273-T275 PolarHBondContact O-N 3.03Å; L273-I276 PolarHBondContact O-N 3.33Å; L273-D277 PolarHBondContact O-N 3.17Å
274	S	52.4	Low	59.8	Low	27 Å²	27	58 Å²	58	19%	0.189	34%	0.342	C	S	.	.	H	α-helix	trans	-54.7	-35.2	175.4	-40.7	0	0	0	0	113.7	N270 K271 I276 T283	N270-S274 PolarHBondContact O-N 3.31Å; N270-S274 PolarHBondContact O-OG 3.37Å; N270-S274 VanDerWaalsContact O-OG 3.09Å; K271-S274 VanDerWaalsContact O-CB 3.31Å; K271-S274 WeakPolarHBondContact O-CB 3.47Å; K271-S274 PolarHBondContact O-N 3.47Å; K271-S274 PolarHBondContact O-OG 2.73Å; S274-I276 VanDerWaalsContact C-N 3.31Å; S274-T283 VanDerWaalsContact CB-OG1 3.25Å; S274-T283 WeakPolarHBondContact CB-OG1 3.45Å; S274-T283 WeakPolarHBondContact OG-CB 3.37Å; S274-T283 VanDerWaalsContact OG-CG2 3.31Å; S274-T283 WeakPolarHBondContact OG-CG2 3.24Å; S274-T283 PolarHBondContact OG-OG1 3.1Å
275	T	50.8	Low	59.2	Low	101 Å²	101	58.4 Å²	58.4	62%	0.62	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-11	-179.4	48.3	0	0	0	0	114.1	K271 N272 L273	K271-T275 PolarHBondContact O-N 3.37Å; N272-T275 WeakPolarHBondContact CA-OG1 3.15Å; N272-T275 PolarHBondContact O-N 2.95Å; N272-T275 PolarHBondContact O-OG1 2.97Å; L273-T275 PolarHBondContact O-N 3.03Å
276	I	51.3	Low	59.4	Low	137 Å²	137	57.9 Å²	57.9	70%	0.703	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-32.9	179	-66.2	165.7	0	0	0	111.1	N272 L273 S274	N272-I276 WeakPolarHBondContact O-CD1 3.4Å; N272-I276 WeakPolarHBondContact O-CG1 3.15Å; L273-I276 PolarHBondContact O-N 3.33Å; S274-I276 VanDerWaalsContact C-N 3.31Å
277	D	50.4	Low	59.9	Low	87 Å²	87	57.4 Å²	57.4	47%	0.465	34%	0.337	S	S	.	.			trans	-122.8	93.9	173	-171.9	-8.9	0	0	0	111.6	L273 S279	L273-D277 PolarHBondContact O-N 3.17Å; D277-S279 PolarHBondContact O-N 2.89Å; D277-S279 VanDerWaalsContact O-N 3.15Å; D277-S279 WeakPolarHBondContact OD1-CB 3.24Å; D277-S279 PolarHBondContact OD1-N 3.31Å; D277-S279 PolarHBondContact OD1-OG 3.12Å; D277-S279 PolarHBondContact OD2-OG 3.01Å
278	P	49.4	Very low	60.5	Low	113 Å²	113	56.4 Å²	56.4	73%	0.734	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-7.4	178.1	-19.6	32.8	0	0	0	114.7	S280	P278-S280 VanDerWaalsContact C-N 3.29Å; P278-S280 PolarHBondContact O-N 2.79Å
279	S	51	Low	61.5	Low	94 Å²	94	53.7 Å²	53.7	66%	0.657	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-11.2	-173.7	75.3	0	0	0	0	114.1	D277 P281	D277-S279 PolarHBondContact O-N 2.89Å; D277-S279 VanDerWaalsContact O-N 3.15Å; D277-S279 WeakPolarHBondContact OD1-CB 3.24Å; D277-S279 PolarHBondContact OD1-N 3.31Å; D277-S279 PolarHBondContact OD1-OG 3.12Å; D277-S279 PolarHBondContact OD2-OG 3.01Å; S279-P281 WeakPolarHBondContact O-CD 3.3Å
280	S	46	Very low	62.6	Low	36 Å²	36	54 Å²	54	25%	0.252	32%	0.32	S	S	.	.			trans	-115.7	95.9	179.3	-161	0	0	0	0	112.1	Y48 P278 S282	Y48-S280 PolarHBondContact OH-OG 3.39Å; P278-S280 VanDerWaalsContact C-N 3.29Å; P278-S280 PolarHBondContact O-N 2.79Å; S280-S282 PolarHBondContact O-N 3.09Å; S280-S282 PolarHBondContact OG-OG 2.93Å
281	P	42.6	Very low	63.6	Low	129 Å²	129	54 Å²	54	84%	0.838	32%	0.319	S	S	*	.			trans	-74.6	9.3	-170.8	-19.1	33.9	0	0	0	116.3	S279	S279-P281 WeakPolarHBondContact O-CD 3.3Å
282	S	46.6	Very low	64.5	Low	47 Å²	47	51.7 Å²	51.7	33%	0.329	32%	0.315	S	S	.	.			trans	-101.2	18.2	-158.2	39.8	0	0	0	0	116	Y48 S280 F358	Y48-S282 PolarHBondContact OH-OG 2.97Å; S280-S282 PolarHBondContact O-N 3.09Å; S280-S282 PolarHBondContact OG-OG 2.93Å; S282-F358 WeakPolarHBondContact O-CE1 3.46Å
283	T	48.9	Very low	65.6	Low	54 Å²	54	55.7 Å²	55.7	33%	0.331	33%	0.329	S	S	.	.			trans	-95.1	100.2	-177.2	59.4	0	0	0	0	112.5	S274	S274-T283 VanDerWaalsContact CB-OG1 3.25Å; S274-T283 WeakPolarHBondContact CB-OG1 3.45Å; S274-T283 WeakPolarHBondContact OG-CB 3.37Å; S274-T283 VanDerWaalsContact OG-CG2 3.31Å; S274-T283 WeakPolarHBondContact OG-CG2 3.24Å; S274-T283 PolarHBondContact OG-OG1 3.1Å
284	P	51.8	Low	66.6	Low	32 Å²	32	54.8 Å²	54.8	21%	0.208	32%	0.324	C	S	.	.				-123	124.4	107.6	32	-26.3	0	0	0	110.9	P333	P284-P333 WeakPolarHBondContact CG-O 3.35Å
285	T	67.5	Low	67.1	Low	23 Å²	23	58.9 Å²	58.9	14%	0.141	34%	0.34	C	S	.	.			trans	-99.6	104.2	172.9	54.3	0	0	0	0	108.8	L267 N270 F358 C360	L267-T285 VanDerWaalsContact CD2-O 3.28Å; L267-T285 WeakPolarHBondContact CD2-O 3.38Å; N270-T285 WeakPolarHBondContact CB-OG1 3.31Å; N270-T285 PolarHBondContact OD1-OG1 3.08Å; T285-F358 CarbonylContact C-O 3.59Å; T285-C360 PolarHBondContact O-SG 3.2Å; T285-C360 WeakPolarHBondContact OG1-CB 3.39Å
286	W	83.6	Confident	67.2	Low	5 Å²	5	64.1 Å²	64.1	2%	0.019	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	152.8	-175.9	-40.4	-42.3	0	0	0	111.9	L332 V335 D336 I338 L352 F358 I359 C360	W286-L332 HydrophobicContact CH2-CB 3.43Å; W286-L332 VanDerWaalsContact CH2-CB 3.43Å; W286-L332 HydrophobicContact CH2-CD1 4.16Å; W286-L332 HydrophobicContact CH2-CG 4.42Å; W286-L332 HydrophobicContact CZ2-CB 3.53Å; W286-L332 WeakPolarHBondContact CZ2-O 3.39Å; W286-L332 HydrophobicContact CZ3-CB 3.95Å; W286-L332 HydrophobicContact CZ3-CD1 4.12Å; W286-L332 PolarHBondContact NE1-O 2.92Å; W286-V335 PolarHBondContact NE1-O 3.03Å; W286-D336 WeakPolarHBondContact CA-O 3.38Å; W286-I338 HydrophobicContact CB-CD1 3.95Å; W286-I338 HydrophobicContact CB-CG1 4.46Å; W286-I338 HydrophobicContact CD2-CD1 3.8Å; W286-I338 HydrophobicContact CE3-CD1 3.51Å; W286-I338 HydrophobicContact CG-CD1 3.97Å; W286-I338 HydrophobicContact CZ3-CD1 4.34Å; W286-L352 HydrophobicContact CZ3-CD1 4.41Å; W286-F358 WeakPolarHBondContact CB-O 2.99Å; W286-F358 HydrophobicContact CD2-CB 3.81Å; W286-F358 VanDerWaalsContact CD2-O 3.31Å; W286-F358 HydrophobicContact CE3-CB 3.89Å; W286-F358 HydrophobicContact CH2-CB 3.69Å; W286-F358 AromaticContact CH2-CD2 3.76Å; W286-F358 HydrophobicContact CH2-CD2 3.76Å; W286-F358 HydrophobicContact CH2-CG 4.01Å; W286-F358 HydrophobicContact CZ2-CB 3.58Å; W286-F358 AromaticContact CZ2-CD2 4Å; W286-F358 HydrophobicContact CZ2-CD2 4Å; W286-F358 AromaticContact CZ2-CG 3.87Å; W286-F358 HydrophobicContact CZ2-CG 3.87Å; W286-F358 HydrophobicContact CZ3-CB 3.85Å; W286-F358 HydrophobicContact CZ3-CD2 4.45Å; W286-F358 PolarHBondContact N-O 3.44Å; W286-I359 HydrophobicContact CE3-CG1 4.46Å; W286-I359 WeakPolarHBondContact O-CA 3.43Å; W286-C360 PolarHBondContact O-N 3.33Å
287	V	89.6	Confident	67.3	Low	0 Å²	0	59.7 Å²	59.7	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	132.7	158	173.8	0	0	0	0	107.7	A263 L266 L267 D336 L337 I338 G361 I363	A263-V287 HydrophobicContact CB-CB 4.31Å; A263-V287 HydrophobicContact CB-CG1 3.9Å; A263-V287 HydrophobicContact CB-CG2 4.5Å; L266-V287 HydrophobicContact CB-CG2 3.92Å; L266-V287 HydrophobicContact CD1-CG2 4.28Å; L267-V287 HydrophobicContact CD1-CG2 4.48Å; L267-V287 HydrophobicContact CD2-CG2 4.34Å; L267-V287 HydrophobicContact CG-CG2 3.98Å; V287-D336 PolarHBondContact N-O 2.84Å; V287-D336 VanDerWaalsContact N-O 3.11Å; V287-L337 HydrophobicContact CB-CD1 4.08Å; V287-L337 HydrophobicContact CG1-CD1 4.02Å; V287-L337 WeakPolarHBondContact O-CA 3.39Å; V287-L337 WeakPolarHBondContact O-CD1 3.38Å; V287-I338 PolarHBondContact O-N 2.88Å; V287-G361 WeakPolarHBondContact CA-O 3.3Å; V287-I363 HydrophobicContact CG1-CD1 3.86Å; V287-I363 HydrophobicContact CG1-CG1 3.97Å
288	V	92.5	Very high	67.4	Low	0 Å²	0	59.8 Å²	59.8	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	122.6	173.7	-173.5	0	0	0	0	108.4	I338 T340 F345 L349 I359 G361 I362 I363	V288-I338 CarbonylContact C-O 3.55Å; V288-I338 WeakPolarHBondContact CA-O 3.28Å; V288-I338 HydrophobicContact CG1-CG2 4.49Å; V288-I338 HydrophobicContact CG2-CB 4.42Å; V288-I338 HydrophobicContact CG2-CD1 4.43Å; V288-T340 HydrophobicContact CG1-CG2 3.57Å; V288-F345 HydrophobicContact CB-CE2 4.04Å; V288-F345 HydrophobicContact CG1-CD2 3.68Å; V288-F345 HydrophobicContact CG1-CE2 3.6Å; V288-F345 HydrophobicContact CG2-CE2 4.44Å; V288-L349 HydrophobicContact CB-CD1 4.47Å; V288-L349 HydrophobicContact CG1-CD1 3.65Å; V288-L349 HydrophobicContact CG2-CD1 3.97Å; V288-I359 HydrophobicContact CG2-CD1 4.01Å; V288-I359 HydrophobicContact CG2-CG1 4.12Å; V288-I359 HydrophobicContact CG2-CG2 4.29Å; V288-G361 PolarHBondContact N-O 2.94Å; V288-I362 CarbonylContact O-C 3.49Å; V288-I362 WeakPolarHBondContact O-CA 3.32Å; V288-I363 PolarHBondContact O-N 2.56Å
289	W	93.5	Very high	67.6	Low	0 Å²	0	57.9 Å²	57.9	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	111.8	176.8	-168.4	-11.7	0	0	0	109.3	F170 D256 A259 I260 L291 L337 I338 F339 T340 I363	F170-W289 HydrophobicContact CD2-CH2 4.34Å; F170-W289 AromaticContact CE2-CH2 3.66Å; F170-W289 HydrophobicContact CE2-CH2 3.66Å; F170-W289 AromaticContact CE2-CZ3 3.7Å; F170-W289 HydrophobicContact CE2-CZ3 3.7Å; F170-W289 HydrophobicContact CZ-CH2 4.48Å; F170-W289 HydrophobicContact CZ-CZ3 4.07Å; D256-W289 HydrophobicContact CB-CH2 4.24Å; D256-W289 HydrophobicContact CB-CZ2 4.45Å; D256-W289 WeakPolarHBondContact OD1-CZ2 3.41Å; A259-W289 HydrophobicContact CB-CD2 4.18Å; A259-W289 HydrophobicContact CB-CE3 4.23Å; A259-W289 HydrophobicContact CB-CH2 3.42Å; A259-W289 VanDerWaalsContact CB-CH2 3.42Å; A259-W289 HydrophobicContact CB-CZ2 3.27Å; A259-W289 HydrophobicContact CB-CZ3 3.89Å; I260-W289 HydrophobicContact CB-CZ3 4.11Å; I260-W289 HydrophobicContact CD1-CZ3 4.37Å; W289-L291 HydrophobicContact CD2-CD2 4.37Å; W289-L291 HydrophobicContact CG-CD2 4.24Å; W289-L291 HydrophobicContact CZ2-CD2 4.37Å; W289-L337 HydrophobicContact CB-CD1 4.15Å; W289-L337 HydrophobicContact CE3-CD2 4.49Å; W289-I338 PolarHBondContact N-O 2.82Å; W289-F339 HydrophobicContact CB-CD1 3.85Å; W289-F339 HydrophobicContact CB-CE1 3.91Å; W289-F339 HydrophobicContact CD2-CE1 4.03Å; W289-F339 AromaticContact CE3-CE1 3.57Å; W289-F339 HydrophobicContact CE3-CE1 3.57Å; W289-F339 HydrophobicContact CE3-CZ 4.01Å; W289-F339 HydrophobicContact CG-CD1 4.48Å; W289-F339 HydrophobicContact CG-CE1 4.25Å; W289-F339 HydrophobicContact CZ3-CE1 4.28Å; W289-F339 HydrophobicContact CZ3-CZ 4.27Å; W289-T340 PolarHBondContact O-N 3.09Å; W289-T340 VanDerWaalsContact O-N 3.12Å; W289-I363 CarbonylContact C-O 3.6Å; W289-I363 WeakPolarHBondContact CA-O 3.07Å; W289-I363 HydrophobicContact CB-CB 4.39Å; W289-I363 HydrophobicContact CD2-CG2 4.46Å; W289-I363 HydrophobicContact CG-CB 4.13Å; W289-I363 HydrophobicContact CG-CG2 4.2Å
290	V	94.5	Very high	68	Low	8 Å²	8	57.7 Å²	57.7	5%	0.048	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	114.7	178.1	-170.9	0	0	0	0	109	T340 F345 I362 I363 I364 H365 F376	V290-T340 CarbonylContact C-O 3.3Å; V290-T340 WeakPolarHBondContact CA-O 3.38Å; V290-T340 HydrophobicContact CG2-CG2 4Å; V290-F345 HydrophobicContact CG2-CD2 3.8Å; V290-F345 HydrophobicContact CG2-CE2 4.35Å; V290-I362 HydrophobicContact CG2-CG2 4.17Å; V290-I363 PolarHBondContact N-O 3.36Å; V290-I364 HydrophobicContact CB-CG1 4.24Å; V290-I364 HydrophobicContact CG2-CG1 4.26Å; V290-H365 WeakPolarHBondContact O-CB 2.97Å; V290-H365 PolarHBondContact O-N 2.78Å; V290-F376 HydrophobicContact CB-CZ 4.48Å; V290-F376 HydrophobicContact CG1-CE1 4.46Å; V290-F376 HydrophobicContact CG1-CZ 4.22Å; V290-F376 HydrophobicContact CG2-CE2 4.3Å; V290-F376 HydrophobicContact CG2-CZ 3.88Å
291	L	90.6	Very high	68.7	Low	16 Å²	16	57.7 Å²	57.7	8%	0.084	33%	0.329	C	S	.	.			trans	-105.6	153	-175.8	-63.7	174.6	0	0	0	111.2	W289 K293 I294 F339 T340 H365	W289-L291 HydrophobicContact CD2-CD2 4.37Å; W289-L291 HydrophobicContact CG-CD2 4.24Å; W289-L291 HydrophobicContact CZ2-CD2 4.37Å; L291-K293 PolarHBondContact O-N 3.29Å; L291-I294 HydrophobicContact CD1-CG1 4.28Å; L291-F339 HydrophobicContact CD1-CB 4.07Å; L291-F339 HydrophobicContact CD1-CD1 4.49Å; L291-F339 HydrophobicContact CD1-CD2 3.98Å; L291-F339 HydrophobicContact CD1-CG 3.95Å; L291-T340 PolarHBondContact N-O 3.19Å; L291-H365 HydrophobicContact CD2-CB 4.28Å
292	P	86.5	Confident	69.9	Low	55 Å²	55	53.7 Å²	53.7	36%	0.357	30%	0.3	S	S	.	.	S	Bend	trans	-59	-29.9	176.6	-28.6	38.7	0	0	0	114.7	L369	P292-L369 HydrophobicContact CB-CD1 3.62Å; P292-L369 HydrophobicContact CG-CD1 3.96Å
293	K	83.1	Confident	71	Confident	156 Å²	156	52.7 Å²	52.7	68%	0.678	29%	0.293	S	S	*	.			trans	-162.9	147.8	-178.4	-174.2	-178.2	177.4	-166.5	0	107.8	L291	L291-K293 PolarHBondContact O-N 3.29Å
294	I	76.3	Confident	71.7	Confident	31 Å²	31	54.6 Å²	54.6	16%	0.159	30%	0.3	C	S	.	.			trans	-110.8	132.9	166.1	-74.3	172	0	0	0	108.7	L291 Y324 F339 T341	L291-I294 HydrophobicContact CD1-CG1 4.28Å; I294-Y324 HydrophobicContact CD1-CD1 4.42Å; I294-Y324 HydrophobicContact CG2-CD1 3.87Å; I294-F339 HydrophobicContact CD1-CB 4.23Å; I294-F339 WeakPolarHBondContact CD1-O 3.48Å; I294-T341 HydrophobicContact CG1-CG2 4.49Å
295	E	62.5	Low	72.1	Confident	113 Å²	113	55.7 Å²	55.7	53%	0.528	30%	0.302	S	S	.	.			trans	-82.6	135	163.7	-59.6	-168.9	135.8	0	0	107.9	S172 S297	S172-E295 WeakPolarHBondContact CA-OE2 3.5Å; S172-E295 WeakPolarHBondContact CB-OE2 3.4Å; E295-S297 PolarHBondContact O-N 3.44Å
296	K	52.8	Low	71.5	Confident	210 Å²	210	56 Å²	56	91%	0.913	31%	0.309	S	S	*	.			trans	-67.3	92.9	-170.9	-67.1	-177.2	177.8	-177.5	0	111.1
297	S	53.5	Low	69.5	Low	45 Å²	45	59.4 Å²	59.4	32%	0.315	33%	0.334	S	S	.	.			trans	-62.9	165.2	155.3	64.3	0	0	0	0	109.5	E295 A299 Y324	E295-S297 PolarHBondContact O-N 3.44Å; S297-A299 PolarHBondContact O-N 3.29Å; S297-A299 VanDerWaalsContact O-N 3.11Å; S297-Y324 VanDerWaalsContact OG-CD2 3.26Å; S297-Y324 WeakPolarHBondContact OG-CD2 3.45Å; S297-Y324 VanDerWaalsContact OG-CG 3.27Å
298	S	52.6	Low	67.2	Low	89 Å²	89	66.1 Å²	66.1	62%	0.622	37%	0.365	S	S	*	.			trans	-63.2	115.8	175.4	38.3	0	0	0	0	109.8	S301	S298-S301 VanDerWaalsContact O-CB 3.28Å; S298-S301 WeakPolarHBondContact O-CB 3.44Å; S298-S301 PolarHBondContact O-N 3.49Å; S298-S301 PolarHBondContact O-OG 3.41Å; S298-S301 PolarHBondContact OG-OG 3.08Å
299	A	53.3	Low	64.7	Low	72 Å²	72	68.3 Å²	68.3	60%	0.595	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	143.8	178.9	0	0	0	0	0	110.9	S297 S301	S297-A299 PolarHBondContact O-N 3.29Å; S297-A299 VanDerWaalsContact O-N 3.11Å; A299-S301 VanDerWaalsContact C-N 3.26Å; A299-S301 PolarHBondContact O-N 2.65Å
300	N	59.6	Low	62.1	Low	90 Å²	90	75.4 Å²	75.4	48%	0.481	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	9.1	-171.4	-57.4	-34.1	0	0	0	116.6	C327 D328 L331	N300-C327 WeakPolarHBondContact OD1-CA 3.49Å; N300-D328 PolarHBondContact OD1-N 3.03Å; N300-L331 HydrophobicContact CB-CD1 3.89Å; N300-L331 WeakPolarHBondContact O-CD1 3.5Å
301	S	60.3	Low	59.3	Low	37 Å²	37	78.1 Å²	78.1	26%	0.259	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-80.8	134.4	168.3	64.8	0	0	0	0	112.1	S298 A299	S298-S301 VanDerWaalsContact O-CB 3.28Å; S298-S301 WeakPolarHBondContact O-CB 3.44Å; S298-S301 PolarHBondContact O-N 3.49Å; S298-S301 PolarHBondContact O-OG 3.41Å; S298-S301 PolarHBondContact OG-OG 3.08Å; A299-S301 VanDerWaalsContact C-N 3.26Å; A299-S301 PolarHBondContact O-N 2.65Å
302	I	69	Low	56.8	Low	45 Å²	45	87.5 Å²	87.5	23%	0.231	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	119.4	164.5	-62.4	177	0	0	0	107.3	I304 K321 I322 L331 Q334 V335	I302-I304 HydrophobicContact CG2-CG1 4.38Å; I302-K321 HydrophobicContact CG2-CB 3.87Å; I302-K321 HydrophobicContact CG2-CG 4.28Å; I302-I322 CarbonylContact C-O 3.58Å; I302-I322 WeakPolarHBondContact CA-O 3.32Å; I302-L331 HydrophobicContact CD1-CB 4.24Å; I302-L331 HydrophobicContact CD1-CD2 4.15Å; I302-Q334 HydrophobicContact CD1-CB 4.32Å; I302-V335 HydrophobicContact CD1-CG2 4.13Å; I302-V335 HydrophobicContact CG1-CG2 4.25Å
303	S	69.4	Low	54.5	Low	26 Å²	26	90.8 Å²	90.8	18%	0.182	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	118	170.2	-57.4	0	0	0	0	109.6	V158 I322	V158-S303 WeakPolarHBondContact CG2-OG 3.36Å; S303-I322 PolarHBondContact N-O 2.99Å; S303-I322 PolarHBondContact O-N 3.5Å
304	I	63.5	Low	52.3	Low	94 Å²	94	86.5 Å²	86.5	48%	0.482	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	121.1	177.7	-56.4	179.5	0	0	0	108.3	I302 P319 K321	I302-I304 HydrophobicContact CG2-CG1 4.38Å; I304-P319 HydrophobicContact CG2-CB 3.68Å; I304-P319 HydrophobicContact CG2-CG 3.68Å; I304-K321 HydrophobicContact CG1-CG 4.38Å
305	F	60.4	Low	50.5	Low	55 Å²	55	90.7 Å²	90.7	24%	0.241	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	123	-178	-168.8	-78.5	0	0	0	113.2	F159 V221 P319 L320	F159-F305 AromaticContact CD2-CD2 3.46Å; F159-F305 HydrophobicContact CD2-CD2 3.46Å; F159-F305 VanDerWaalsContact CD2-CD2 3.46Å; F159-F305 AromaticContact CD2-CE2 3.37Å; F159-F305 HydrophobicContact CD2-CE2 3.37Å; F159-F305 HydrophobicContact CD2-CZ 4.44Å; F159-F305 AromaticContact CE2-CD2 3.15Å; F159-F305 HydrophobicContact CE2-CD2 3.15Å; F159-F305 AromaticContact CE2-CE2 3.46Å; F159-F305 HydrophobicContact CE2-CE2 3.46Å; F159-F305 VanDerWaalsContact CE2-CE2 3.46Å; F159-F305 AromaticContact CE2-CG 3.86Å; F159-F305 HydrophobicContact CE2-CG 3.86Å; F159-F305 HydrophobicContact CE2-CZ 4.4Å; F159-F305 HydrophobicContact CG-CD2 4.5Å; F159-F305 HydrophobicContact CG-CE2 4.02Å; F159-F305 AromaticContact CZ-CD2 3.99Å; F159-F305 HydrophobicContact CZ-CD2 3.99Å; F159-F305 HydrophobicContact CZ-CE2 4.14Å; F159-F305 HydrophobicContact CZ-CG 4.38Å; V221-F305 VanDerWaalsContact C-CE1 3.49Å; V221-F305 HydrophobicContact CG1-CD1 4.29Å; V221-F305 WeakPolarHBondContact O-CE1 3.27Å; F305-P319 CarbonylContact O-C 3.58Å; F305-P319 VanDerWaalsContact O-C 3.31Å; F305-P319 WeakPolarHBondContact O-CA 3.43Å; F305-P319 WeakPolarHBondContact O-CB 3.45Å; F305-L320 PolarHBondContact N-O 3.4Å; F305-L320 PolarHBondContact O-N 3.47Å
306	G	54.3	Low	49.6	Very low	29 Å²	29	88.9 Å²	88.9	30%	0.299	50%	0.504	S	S	.	.	S	Bend	trans	137.9	169.2	175.4	0	0	0	0	0	111.1	P220 Q308	P220-G306 WeakPolarHBondContact O-CA 3.24Å; G306-Q308 PolarHBondContact O-N 2.89Å
307	S	42.2	Very low	49.5	Very low	77 Å²	77	81.6 Å²	81.6	54%	0.538	47%	0.473	S	S	.	.			trans	-69.5	123.8	173	-173	0	0	0	0	109.3	S309	S307-S309 PolarHBondContact O-N 2.94Å
308	Q	41.5	Very low	49.7	Very low	140 Å²	140	85.4 Å²	85.4	65%	0.654	48%	0.481	S	S	*	.			trans	-76.1	116.5	162.9	-65	-164.6	42.2	0	0	107.7	G306	G306-Q308 PolarHBondContact O-N 2.89Å
309	S	39.8	Very low	50.3	Low	47 Å²	47	82.3 Å²	82.3	33%	0.329	46%	0.458	S	S	.	.			trans	-85.2	114.7	168.3	170.6	0	0	0	0	108.7	S307 N311	S307-S309 PolarHBondContact O-N 2.94Å; S309-N311 PolarHBondContact O-N 2.93Å; S309-N311 PolarHBondContact OG-N 3.01Å; S309-N311 PolarHBondContact OG-O 2.79Å
310	D	37.6	Very low	51.3	Low	148 Å²	148	79.2 Å²	79.2	79%	0.791	43%	0.432	S	S	*	.	S	Bend	trans	-64.7	-19.5	171.7	-68.3	-53.2	0	0	0	112.4	K312	D310-K312 PolarHBondContact O-N 2.64Å
311	N	37.7	Very low	52.3	Low	66 Å²	66	77.6 Å²	77.6	35%	0.353	42%	0.42	S	S	.	.			trans	-75.8	105.4	173.4	-75.6	-30.7	0	0	0	110.9	S309 T313 D314	S309-N311 PolarHBondContact O-N 2.93Å; S309-N311 PolarHBondContact OG-N 3.01Å; S309-N311 PolarHBondContact OG-O 2.79Å; N311-T313 PolarHBondContact O-N 3.31Å; N311-D314 PolarHBondContact O-N 2.81Å
312	K	37.9	Very low	53.4	Low	212 Å²	212	75.8 Å²	75.8	92%	0.922	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-2.9	176.3	-71.2	178.8	175.8	173.5	0	115.8	D310	D310-K312 PolarHBondContact O-N 2.64Å
313	T	37.6	Very low	54.2	Low	125 Å²	125	73.7 Å²	73.7	77%	0.767	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-18.8	-173.2	45.5	0	0	0	0	114.7	N311 T315	N311-T313 PolarHBondContact O-N 3.31Å; T313-T315 PolarHBondContact O-N 3.44Å
314	D	37	Very low	55	Low	65 Å²	65	73.8 Å²	73.8	35%	0.348	39%	0.394	S	S	.	.			trans	-90.8	93.8	175.9	-174.2	0.1	0	0	0	111.1	N311 S316	N311-D314 PolarHBondContact O-N 2.81Å; D314-S316 VanDerWaalsContact CG-OG 3.3Å; D314-S316 PolarHBondContact O-N 3.45Å; D314-S316 WeakPolarHBondContact OD1-CB 3.29Å; D314-S316 PolarHBondContact OD1-N 2.68Å; D314-S316 PolarHBondContact OD1-OG 3.37Å; D314-S316 PolarHBondContact OD2-OG 3Å
315	T	39.1	Very low	56	Low	119 Å²	119	69.8 Å²	69.8	73%	0.73	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	1.1	-179.8	54.4	0	0	0	0	114.4	K271 T313	K271-T315 PolarHBondContact NZ-O 3.09Å; T313-T315 PolarHBondContact O-N 3.44Å
316	S	43	Very low	57.1	Low	76 Å²	76	70.5 Å²	70.5	53%	0.531	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-26.5	-178.1	75.2	0	0	0	0	114.1	D314	D314-S316 VanDerWaalsContact CG-OG 3.3Å; D314-S316 PolarHBondContact O-N 3.45Å; D314-S316 WeakPolarHBondContact OD1-CB 3.29Å; D314-S316 PolarHBondContact OD1-N 2.68Å; D314-S316 PolarHBondContact OD1-OG 3.37Å; D314-S316 PolarHBondContact OD2-OG 3Å
317	Q	50.2	Low	58.3	Low	57 Å²	57	70.1 Å²	70.1	27%	0.266	38%	0.376	S	S	.	.			trans	-110.5	76.3	-173.4	-65.2	-172.4	72.2	0	0	112.9	P220	P220-Q317 HydrophobicContact CG-CG 4.47Å
318	R	58	Low	59.9	Low	125 Å²	125	69.1 Å²	69.1	47%	0.472	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-82.8	124.4	160.5	170.5	172.9	166.5	156.5	-6.2	108.5	D336	R318-D336 IonicContact CZ-OD1 2.64Å; R318-D336 IonicContact CZ-OD2 3.49Å; R318-D336 IonicContact NE-OD1 3.98Å; R318-D336 PolarHBondContact NE-OD1 3.22Å; R318-D336 IonicContact NE-OD2 2.56Å; R318-D336 IonicContact NH2-OD1 2.79Å; R318-D336 PolarHBondContact NH2-OD1 3.06Å; R318-D336 IonicContact NH2-OD2 3.55Å; R318-D336 PolarHBondContact NH2-OD2 3.33Å
319	P	65.7	Low	61.5	Low	23 Å²	23	67 Å²	67	15%	0.149	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-67.5	137.4	172	28.7	-34.4	0	0	0	110.5	I304 F305 K321	I304-P319 HydrophobicContact CG2-CB 3.68Å; I304-P319 HydrophobicContact CG2-CG 3.68Å; F305-P319 CarbonylContact O-C 3.58Å; F305-P319 VanDerWaalsContact O-C 3.31Å; F305-P319 WeakPolarHBondContact O-CA 3.43Å; F305-P319 WeakPolarHBondContact O-CB 3.45Å; P319-K321 PolarHBondContact O-N 2.88Å
320	L	74.6	Confident	63.2	Low	8 Å²	8	71.9 Å²	71.9	4%	0.042	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	121	177.7	-175.3	76.6	0	0	0	109.8	V221 I260 L267 F305 I322 D336 L337	V221-L320 HydrophobicContact CG1-CD2 3.86Å; V221-L320 HydrophobicContact CG2-CB 4.17Å; I260-L320 HydrophobicContact CD1-CD2 4.06Å; L267-L320 HydrophobicContact CD1-CD1 3.54Å; F305-L320 PolarHBondContact N-O 3.4Å; F305-L320 PolarHBondContact O-N 3.47Å; L320-I322 HydrophobicContact CD2-CD1 4.3Å; L320-I322 HydrophobicContact CD2-CG1 4.2Å; L320-I322 HydrophobicContact CG-CG1 4.33Å; L320-D336 HydrophobicContact CD1-CB 3.57Å; L320-D336 HydrophobicContact CG-CB 4.38Å; L320-L337 HydrophobicContact CD1-CB 4.42Å; L320-L337 HydrophobicContact CD2-CB 4.41Å; L320-L337 HydrophobicContact CD2-CD2 3.89Å; L320-L337 HydrophobicContact CG-CB 4.48Å
321	K	80.2	Confident	65	Low	55 Å²	55	66.7 Å²	66.7	24%	0.239	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	119.4	177.6	-67	176.9	174.3	-175.7	0	110.4	I302 I304 P319 Q334 V335 D336 L337	I302-K321 HydrophobicContact CG2-CB 3.87Å; I302-K321 HydrophobicContact CG2-CG 4.28Å; I304-K321 HydrophobicContact CG1-CG 4.38Å; P319-K321 PolarHBondContact O-N 2.88Å; K321-Q334 WeakPolarHBondContact CD-O 3.25Å; K321-V335 WeakPolarHBondContact O-CG1 3.25Å; K321-D336 WeakPolarHBondContact CB-OD2 3.47Å; K321-D336 PolarHBondContact N-OD2 3.32Å; K321-D336 PolarHBondContact O-N 3.46Å; K321-L337 PolarHBondContact O-N 3.39Å
322	I	83.1	Confident	66.9	Low	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	135.5	-177.8	-49.5	178.4	0	0	0	109.4	F159 F170 I302 S303 L320 Y324 L337 F339	F159-I322 HydrophobicContact CE2-CD1 4.4Å; F159-I322 HydrophobicContact CZ-CD1 4.4Å; F170-I322 HydrophobicContact CE1-CD1 4.39Å; I302-I322 CarbonylContact C-O 3.58Å; I302-I322 WeakPolarHBondContact CA-O 3.32Å; S303-I322 PolarHBondContact N-O 2.99Å; S303-I322 PolarHBondContact O-N 3.5Å; L320-I322 HydrophobicContact CD2-CD1 4.3Å; L320-I322 HydrophobicContact CD2-CG1 4.2Å; L320-I322 HydrophobicContact CG-CG1 4.33Å; I322-Y324 HydrophobicContact CG2-CE2 4.44Å; I322-L337 VanDerWaalsContact CA-O 3.28Å; I322-L337 WeakPolarHBondContact CA-O 3.26Å; I322-L337 HydrophobicContact CD1-CD2 4.44Å; I322-L337 HydrophobicContact CG1-CB 4.37Å; I322-L337 HydrophobicContact CG1-CD2 4.39Å; I322-F339 HydrophobicContact CG2-CD1 4.46Å; I322-F339 HydrophobicContact CG2-CD2 4.09Å; I322-F339 HydrophobicContact CG2-CE1 4.46Å; I322-F339 HydrophobicContact CG2-CE2 4.07Å; I322-F339 HydrophobicContact CG2-CG 4.3Å; I322-F339 HydrophobicContact CG2-CZ 4.27Å
323	A	84.6	Confident	68.6	Low	1 Å²	1	57.1 Å²	57.1	1%	0.008	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	158.7	169.6	0	0	0	0	0	111.5	V335 L337 F339	A323-V335 HydrophobicContact CB-CB 4.44Å; A323-V335 HydrophobicContact CB-CG1 3.91Å; A323-V335 HydrophobicContact CB-CG2 3.58Å; A323-L337 PolarHBondContact N-O 3.06Å; A323-F339 PolarHBondContact O-N 3.09Å
324	Y	86.3	Confident	70.4	Confident	28 Å²	28	56 Å²	56	11%	0.11	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	135.2	178.4	-64.8	-103.2	0	0	0	109	I294 S297 I322 P326 F339	I294-Y324 HydrophobicContact CD1-CD1 4.42Å; I294-Y324 HydrophobicContact CG2-CD1 3.87Å; S297-Y324 VanDerWaalsContact OG-CD2 3.26Å; S297-Y324 WeakPolarHBondContact OG-CD2 3.45Å; S297-Y324 VanDerWaalsContact OG-CG 3.27Å; I322-Y324 HydrophobicContact CG2-CE2 4.44Å; Y324-P326 CarbonylContact O-C 3.36Å; Y324-F339 HydrophobicContact CD1-CB 3.93Å; Y324-F339 HydrophobicContact CD1-CD2 4.22Å; Y324-F339 HydrophobicContact CE1-CB 4.2Å; Y324-F339 AromaticContact CE1-CD2 3.62Å; Y324-F339 HydrophobicContact CE1-CD2 3.62Å; Y324-F339 HydrophobicContact CE1-CG 4.4Å; Y324-F339 HydrophobicContact CG-CB 4.46Å; Y324-F339 AromaticContact CZ-CD2 3.82Å
325	L	85.4	Confident	72.5	Confident	9 Å²	9	53 Å²	53	5%	0.047	28%	0.281	C	S	.	.	S	Bend	trans	-80.8	147.2	170.3	-75.1	178.6	0	0	0	111.6	I338 F339 L344 H348 L349	L325-I338 HydrophobicContact CD1-CG2 4.13Å; L325-I338 HydrophobicContact CG-CG2 3.98Å; L325-F339 PolarHBondContact N-O 2.99Å; L325-L344 HydrophobicContact CB-CB 4.36Å; L325-H348 HydrophobicContact CD1-CB 4.12Å; L325-H348 HydrophobicContact CD2-CB 4.27Å; L325-L349 HydrophobicContact CD1-CD1 3.66Å; L325-L349 HydrophobicContact CD1-CD2 4Å; L325-L349 HydrophobicContact CD1-CG 3.61Å
326	P	83.9	Confident	74.6	Confident	70 Å²	70	48 Å²	48	46%	0.455	25%	0.25	S	S	.	.	S	Bend	cis	-73	141	-4.9	29.1	-34.9	0	0	0	113.7	Y324	Y324-P326 CarbonylContact O-C 3.36Å
327	C	79.1	Confident	76.7	Confident	21 Å²	21	44.3 Å²	44.3	14%	0.142	23%	0.225	C	C	.	.			trans	-145.7	160.6	169.9	71.7	0	0	0	0	112.5	N300 T329	N300-C327 WeakPolarHBondContact OD1-CA 3.49Å; C327-T329 PolarHBondContact O-N 3.25Å
328	D	76.1	Confident	78.6	Confident	57 Å²	57	41.6 Å²	41.6	31%	0.305	21%	0.212	S	C	.	.			trans	-58.4	127.3	175.6	-171.8	-20	0	0	0	110.6	N300 K330 L331	N300-D328 PolarHBondContact OD1-N 3.03Å; D328-K330 PolarHBondContact O-N 3.41Å; D328-K330 VanDerWaalsContact O-N 3.09Å; D328-K330 WeakPolarHBondContact OD1-CB 3.26Å; D328-K330 VanDerWaalsContact OD1-CG 3.3Å; D328-K330 WeakPolarHBondContact OD1-CG 3.42Å; D328-K330 PolarHBondContact OD1-N 3.06Å; D328-K330 IonicContact OD1-NZ 3.17Å; D328-K330 PolarHBondContact OD1-NZ 3.07Å; D328-K330 IonicContact OD2-NZ 2.64Å; D328-K330 PolarHBondContact OD2-NZ 2.89Å; D328-L331 HydrophobicContact CB-CD1 4.32Å; D328-L331 HydrophobicContact CB-CG 4.34Å; D328-L331 WeakPolarHBondContact O-CB 3.42Å; D328-L331 PolarHBondContact O-N 2.92Å
329	T	75	Confident	80.1	Confident	95 Å²	95	35.8 Å²	35.8	58%	0.583	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-23.1	-179.4	52.9	0	0	0	0	113.1	C327 L331 L332 P333	C327-T329 PolarHBondContact O-N 3.25Å; T329-L331 PolarHBondContact O-N 2.86Å; T329-L332 HydrophobicContact CG2-CD1 4.26Å; T329-L332 PolarHBondContact O-N 2.93Å; T329-P333 WeakPolarHBondContact O-CD 3.38Å
330	K	75.1	Confident	81.3	Confident	149 Å²	149	34.7 Å²	34.7	65%	0.648	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-20.9	173.7	-60.5	177.2	-145.3	73.4	0	113.9	D328	D328-K330 PolarHBondContact O-N 3.41Å; D328-K330 VanDerWaalsContact O-N 3.09Å; D328-K330 WeakPolarHBondContact OD1-CB 3.26Å; D328-K330 VanDerWaalsContact OD1-CG 3.3Å; D328-K330 WeakPolarHBondContact OD1-CG 3.42Å; D328-K330 PolarHBondContact OD1-N 3.06Å; D328-K330 IonicContact OD1-NZ 3.17Å; D328-K330 PolarHBondContact OD1-NZ 3.07Å; D328-K330 IonicContact OD2-NZ 2.64Å; D328-K330 PolarHBondContact OD2-NZ 2.89Å
331	L	75.6	Confident	82.2	Confident	40 Å²	40	35.2 Å²	35.2	21%	0.209	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-31.9	177.1	-63.8	174.1	0	0	0	111.7	N300 I302 D328 T329 Q334	N300-L331 HydrophobicContact CB-CD1 3.89Å; N300-L331 WeakPolarHBondContact O-CD1 3.5Å; I302-L331 HydrophobicContact CD1-CB 4.24Å; I302-L331 HydrophobicContact CD1-CD2 4.15Å; D328-L331 HydrophobicContact CB-CD1 4.32Å; D328-L331 HydrophobicContact CB-CG 4.34Å; D328-L331 WeakPolarHBondContact O-CB 3.42Å; D328-L331 PolarHBondContact O-N 2.92Å; T329-L331 PolarHBondContact O-N 2.86Å; L331-Q334 WeakPolarHBondContact O-CB 3.49Å; L331-Q334 PolarHBondContact O-N 3.32Å
332	L	77	Confident	82.9	Confident	4 Å²	4	33.5 Å²	33.5	2%	0.021	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-54.9	-42.5	-172.3	-55	174.5	0	0	0	113.8	W286 T329 Q334 V335 I338 L352	W286-L332 HydrophobicContact CH2-CB 3.43Å; W286-L332 VanDerWaalsContact CH2-CB 3.43Å; W286-L332 HydrophobicContact CH2-CD1 4.16Å; W286-L332 HydrophobicContact CH2-CG 4.42Å; W286-L332 HydrophobicContact CZ2-CB 3.53Å; W286-L332 WeakPolarHBondContact CZ2-O 3.39Å; W286-L332 HydrophobicContact CZ3-CB 3.95Å; W286-L332 HydrophobicContact CZ3-CD1 4.12Å; W286-L332 PolarHBondContact NE1-O 2.92Å; T329-L332 HydrophobicContact CG2-CD1 4.26Å; T329-L332 PolarHBondContact O-N 2.93Å; L332-Q334 PolarHBondContact O-N 3.37Å; L332-V335 WeakPolarHBondContact O-CB 3.28Å; L332-V335 PolarHBondContact O-N 3.06Å; L332-I338 HydrophobicContact CD2-CD1 3.89Å; L332-I338 HydrophobicContact CD2-CG1 4.35Å; L332-L352 HydrophobicContact CD1-CD1 4.04Å
333	P	74.3	Confident	83.3	Confident	73 Å²	73	37.5 Å²	37.5	47%	0.474	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-60.2	-11.3	176	-24.8	35.7	0	0	0	115.3	P284 T329	P284-P333 WeakPolarHBondContact CG-O 3.35Å; T329-P333 WeakPolarHBondContact O-CD 3.38Å
334	Q	74.8	Confident	83.7	Confident	102 Å²	102	39.2 Å²	39.2	48%	0.477	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-103	-5.4	175.2	-55	-174.1	51.8	0	0	113.2	I302 K321 L331 L332	I302-Q334 HydrophobicContact CD1-CB 4.32Å; K321-Q334 WeakPolarHBondContact CD-O 3.25Å; L331-Q334 WeakPolarHBondContact O-CB 3.49Å; L331-Q334 PolarHBondContact O-N 3.32Å; L332-Q334 PolarHBondContact O-N 3.37Å
335	V	81.2	Confident	84	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.206	C	C	.	.			trans	-90.6	154.5	-178.7	176.3	0	0	0	0	109.9	W286 I302 K321 A323 L332 L337 I338	W286-V335 PolarHBondContact NE1-O 3.03Å; I302-V335 HydrophobicContact CD1-CG2 4.13Å; I302-V335 HydrophobicContact CG1-CG2 4.25Å; K321-V335 WeakPolarHBondContact O-CG1 3.25Å; A323-V335 HydrophobicContact CB-CB 4.44Å; A323-V335 HydrophobicContact CB-CG1 3.91Å; A323-V335 HydrophobicContact CB-CG2 3.58Å; L332-V335 WeakPolarHBondContact O-CB 3.28Å; L332-V335 PolarHBondContact O-N 3.06Å; V335-L337 VanDerWaalsContact CG1-O 3.25Å; V335-L337 WeakPolarHBondContact CG1-O 3.41Å; V335-I338 HydrophobicContact CG1-CG1 3.73Å
336	D	84.2	Confident	84.4	Confident	14 Å²	14	39.3 Å²	39.3	8%	0.075	22%	0.215	C	C	.	.	S	Bend	trans	-112	-37.1	173	-58.4	-59.3	0	0	0	111.1	L267 W286 V287 R318 L320 K321	L267-D336 HydrophobicContact CD1-CB 4.1Å; L267-D336 HydrophobicContact CD2-CB 4.38Å; L267-D336 WeakPolarHBondContact CD2-O 3.22Å; W286-D336 WeakPolarHBondContact CA-O 3.38Å; V287-D336 PolarHBondContact N-O 2.84Å; V287-D336 VanDerWaalsContact N-O 3.11Å; R318-D336 IonicContact CZ-OD1 2.64Å; R318-D336 IonicContact CZ-OD2 3.49Å; R318-D336 IonicContact NE-OD1 3.98Å; R318-D336 PolarHBondContact NE-OD1 3.22Å; R318-D336 IonicContact NE-OD2 2.56Å; R318-D336 IonicContact NH2-OD1 2.79Å; R318-D336 PolarHBondContact NH2-OD1 3.06Å; R318-D336 IonicContact NH2-OD2 3.55Å; R318-D336 PolarHBondContact NH2-OD2 3.33Å; L320-D336 HydrophobicContact CD1-CB 3.57Å; L320-D336 HydrophobicContact CG-CB 4.38Å; K321-D336 WeakPolarHBondContact CB-OD2 3.47Å; K321-D336 PolarHBondContact N-OD2 3.32Å; K321-D336 PolarHBondContact O-N 3.46Å
337	L	87.1	Confident	84.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	125.6	-177.2	178.1	57.2	0	0	0	111.4	I260 A263 V287 W289 L320 K321 I322 A323 V335 F339	I260-L337 HydrophobicContact CD1-CD2 3.82Å; A263-L337 HydrophobicContact CB-CD1 4.32Å; V287-L337 HydrophobicContact CB-CD1 4.08Å; V287-L337 HydrophobicContact CG1-CD1 4.02Å; V287-L337 WeakPolarHBondContact O-CA 3.39Å; V287-L337 WeakPolarHBondContact O-CD1 3.38Å; W289-L337 HydrophobicContact CB-CD1 4.15Å; W289-L337 HydrophobicContact CE3-CD2 4.49Å; L320-L337 HydrophobicContact CD1-CB 4.42Å; L320-L337 HydrophobicContact CD2-CB 4.41Å; L320-L337 HydrophobicContact CD2-CD2 3.89Å; L320-L337 HydrophobicContact CG-CB 4.48Å; K321-L337 PolarHBondContact O-N 3.39Å; I322-L337 VanDerWaalsContact CA-O 3.28Å; I322-L337 WeakPolarHBondContact CA-O 3.26Å; I322-L337 HydrophobicContact CD1-CD2 4.44Å; I322-L337 HydrophobicContact CG1-CB 4.37Å; I322-L337 HydrophobicContact CG1-CD2 4.39Å; A323-L337 PolarHBondContact N-O 3.06Å; V335-L337 VanDerWaalsContact CG1-O 3.25Å; V335-L337 WeakPolarHBondContact CG1-O 3.41Å; L337-F339 HydrophobicContact CD1-CD1 4.36Å; L337-F339 HydrophobicContact CD1-CE1 3.97Å; L337-F339 HydrophobicContact CD2-CE1 3.64Å; L337-F339 HydrophobicContact CD2-CZ 4.06Å; L337-F339 HydrophobicContact CG-CD1 4.12Å; L337-F339 HydrophobicContact CG-CE1 3.62Å; L337-F339 HydrophobicContact CG-CZ 4.43Å
338	I	88.7	Confident	85.2	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	125.6	-178.7	-61.6	164.8	0	0	0	109.8	W286 V287 V288 W289 L325 L332 V335 L349	W286-I338 HydrophobicContact CB-CD1 3.95Å; W286-I338 HydrophobicContact CB-CG1 4.46Å; W286-I338 HydrophobicContact CD2-CD1 3.8Å; W286-I338 HydrophobicContact CE3-CD1 3.51Å; W286-I338 HydrophobicContact CG-CD1 3.97Å; W286-I338 HydrophobicContact CZ3-CD1 4.34Å; V287-I338 PolarHBondContact O-N 2.88Å; V288-I338 CarbonylContact C-O 3.55Å; V288-I338 WeakPolarHBondContact CA-O 3.28Å; V288-I338 HydrophobicContact CG1-CG2 4.49Å; V288-I338 HydrophobicContact CG2-CB 4.42Å; V288-I338 HydrophobicContact CG2-CD1 4.43Å; W289-I338 PolarHBondContact N-O 2.82Å; L325-I338 HydrophobicContact CD1-CG2 4.13Å; L325-I338 HydrophobicContact CG-CG2 3.98Å; L332-I338 HydrophobicContact CD2-CD1 3.89Å; L332-I338 HydrophobicContact CD2-CG1 4.35Å; V335-I338 HydrophobicContact CG1-CG1 3.73Å; I338-L349 HydrophobicContact CG2-CD1 4.48Å
339	F	89.9	Confident	85.8	Confident	3 Å²	3	41.7 Å²	41.7	1%	0.013	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	129.8	172.6	-70.6	-5.3	0	0	0	110.8	F170 W289 L291 I294 I322 A323 Y324 L325 L337	F170-F339 AromaticContact CD1-CE2 3.92Å; F170-F339 HydrophobicContact CD1-CE2 3.92Å; F170-F339 HydrophobicContact CD1-CZ 4.25Å; F170-F339 AromaticContact CE1-CE2 3.6Å; F170-F339 HydrophobicContact CE1-CE2 3.6Å; F170-F339 AromaticContact CE1-CZ 3.55Å; F170-F339 HydrophobicContact CE1-CZ 3.55Å; F170-F339 HydrophobicContact CE2-CZ 4.26Å; F170-F339 HydrophobicContact CZ-CE2 4.1Å; F170-F339 AromaticContact CZ-CZ 3.58Å; F170-F339 HydrophobicContact CZ-CZ 3.58Å; W289-F339 HydrophobicContact CB-CD1 3.85Å; W289-F339 HydrophobicContact CB-CE1 3.91Å; W289-F339 HydrophobicContact CD2-CE1 4.03Å; W289-F339 AromaticContact CE3-CE1 3.57Å; W289-F339 HydrophobicContact CE3-CE1 3.57Å; W289-F339 HydrophobicContact CE3-CZ 4.01Å; W289-F339 HydrophobicContact CG-CD1 4.48Å; W289-F339 HydrophobicContact CG-CE1 4.25Å; W289-F339 HydrophobicContact CZ3-CE1 4.28Å; W289-F339 HydrophobicContact CZ3-CZ 4.27Å; L291-F339 HydrophobicContact CD1-CB 4.07Å; L291-F339 HydrophobicContact CD1-CD1 4.49Å; L291-F339 HydrophobicContact CD1-CD2 3.98Å; L291-F339 HydrophobicContact CD1-CG 3.95Å; I294-F339 HydrophobicContact CD1-CB 4.23Å; I294-F339 WeakPolarHBondContact CD1-O 3.48Å; I322-F339 HydrophobicContact CG2-CD1 4.46Å; I322-F339 HydrophobicContact CG2-CD2 4.09Å; I322-F339 HydrophobicContact CG2-CE1 4.46Å; I322-F339 HydrophobicContact CG2-CE2 4.07Å; I322-F339 HydrophobicContact CG2-CG 4.3Å; I322-F339 HydrophobicContact CG2-CZ 4.27Å; A323-F339 PolarHBondContact O-N 3.09Å; Y324-F339 HydrophobicContact CD1-CB 3.93Å; Y324-F339 HydrophobicContact CD1-CD2 4.22Å; Y324-F339 HydrophobicContact CE1-CB 4.2Å; Y324-F339 AromaticContact CE1-CD2 3.62Å; Y324-F339 HydrophobicContact CE1-CD2 3.62Å; Y324-F339 HydrophobicContact CE1-CG 4.4Å; Y324-F339 HydrophobicContact CG-CB 4.46Å; Y324-F339 AromaticContact CZ-CD2 3.82Å; L325-F339 PolarHBondContact N-O 2.99Å; L337-F339 HydrophobicContact CD1-CD1 4.36Å; L337-F339 HydrophobicContact CD1-CE1 3.97Å; L337-F339 HydrophobicContact CD2-CE1 3.64Å; L337-F339 HydrophobicContact CD2-CZ 4.06Å; L337-F339 HydrophobicContact CG-CD1 4.12Å; L337-F339 HydrophobicContact CG-CE1 3.62Å; L337-F339 HydrophobicContact CG-CZ 4.43Å
340	T	91.8	Very high	86.6	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	164	-179.1	-172	0	0	0	0	112.1	V288 W289 V290 L291 L344 F345	V288-T340 HydrophobicContact CG1-CG2 3.57Å; W289-T340 PolarHBondContact O-N 3.09Å; W289-T340 VanDerWaalsContact O-N 3.12Å; V290-T340 CarbonylContact C-O 3.3Å; V290-T340 WeakPolarHBondContact CA-O 3.38Å; V290-T340 HydrophobicContact CG2-CG2 4Å; L291-T340 PolarHBondContact N-O 3.19Å; T340-L344 WeakPolarHBondContact OG1-CB 3.43Å; T340-F345 HydrophobicContact CG2-CB 3.97Å; T340-F345 HydrophobicContact CG2-CD2 3.84Å; T340-F345 HydrophobicContact CG2-CG 4.39Å; T340-F345 PolarHBondContact OG1-N 2.93Å; T340-F345 VanDerWaalsContact OG1-N 3.15Å
341	T	92.8	Very high	87	Confident	18 Å²	18	37.1 Å²	37.1	11%	0.11	20%	0.197	C	C	.	.			trans	-90.1	172.7	157.3	69.7	0	0	0	0	110	I294 D343 L344 F345	I294-T341 HydrophobicContact CG1-CG2 4.49Å; T341-D343 WeakPolarHBondContact CB-OD2 3.36Å; T341-D343 PolarHBondContact O-N 3.11Å; T341-D343 PolarHBondContact OG1-N 3.39Å; T341-D343 PolarHBondContact OG1-OD2 2.73Å; T341-L344 PolarHBondContact OG1-N 2.83Å; T341-F345 WeakPolarHBondContact O-CB 3.32Å; T341-F345 PolarHBondContact O-N 2.78Å
342	S	94.6	Very high	87.4	Confident	19 Å²	19	37.1 Å²	37.1	13%	0.133	20%	0.197	C	C	.	.	H	α-helix	trans	-55.4	-37.5	172.9	38.6	0	0	0	0	112.7	F345 V346	S342-F345 WeakPolarHBondContact O-CB 3.43Å; S342-F345 PolarHBondContact O-N 3Å; S342-V346 WeakPolarHBondContact O-CG2 3.46Å; S342-V346 PolarHBondContact O-N 2.65Å; S342-V346 VanDerWaalsContact O-N 3.13Å
343	D	92.8	Very high	87.9	Confident	85 Å²	85	37 Å²	37	46%	0.455	20%	0.196	S	C	.	.	H	α-helix	trans	-78	-48.2	-170.3	-21.9	-70	0	0	0	109.4	T341 F345 V346 E347 N373	T341-D343 WeakPolarHBondContact CB-OD2 3.36Å; T341-D343 PolarHBondContact O-N 3.11Å; T341-D343 PolarHBondContact OG1-N 3.39Å; T341-D343 PolarHBondContact OG1-OD2 2.73Å; D343-F345 PolarHBondContact O-N 2.68Å; D343-V346 PolarHBondContact O-N 3.06Å; D343-V346 VanDerWaalsContact O-N 3.14Å; D343-E347 PolarHBondContact O-N 3.48Å; D343-N373 PolarHBondContact OD1-ND2 3.1Å
344	L	92.1	Very high	88.5	Confident	36 Å²	36	36.2 Å²	36.2	19%	0.188	19%	0.187	C	C	.	.	H	α-helix	trans	-64.6	-26.2	172.5	-66.7	170	0	0	0	112.6	L325 T340 T341 H348	L325-L344 HydrophobicContact CB-CB 4.36Å; T340-L344 WeakPolarHBondContact OG1-CB 3.43Å; T341-L344 PolarHBondContact OG1-N 2.83Å; L344-H348 WeakPolarHBondContact CD2-NE2 3.3Å; L344-H348 WeakPolarHBondContact O-CB 3.31Å; L344-H348 PolarHBondContact O-CD2 2.8Å; L344-H348 VanDerWaalsContact O-CD2 3.31Å; L344-H348 PolarHBondContact O-N 3.28Å
345	F	93.5	Very high	88.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-66.6	-49.6	171.2	-170.5	-64.6	0	0	0	110.1	V288 V290 T340 T341 S342 D343 E347 L349 S350 L353 I362 F376 L379	V288-F345 HydrophobicContact CB-CE2 4.04Å; V288-F345 HydrophobicContact CG1-CD2 3.68Å; V288-F345 HydrophobicContact CG1-CE2 3.6Å; V288-F345 HydrophobicContact CG2-CE2 4.44Å; V290-F345 HydrophobicContact CG2-CD2 3.8Å; V290-F345 HydrophobicContact CG2-CE2 4.35Å; T340-F345 HydrophobicContact CG2-CB 3.97Å; T340-F345 HydrophobicContact CG2-CD2 3.84Å; T340-F345 HydrophobicContact CG2-CG 4.39Å; T340-F345 PolarHBondContact OG1-N 2.93Å; T340-F345 VanDerWaalsContact OG1-N 3.15Å; T341-F345 WeakPolarHBondContact O-CB 3.32Å; T341-F345 PolarHBondContact O-N 2.78Å; S342-F345 WeakPolarHBondContact O-CB 3.43Å; S342-F345 PolarHBondContact O-N 3Å; D343-F345 PolarHBondContact O-N 2.68Å; F345-E347 VanDerWaalsContact C-N 3.32Å; F345-E347 PolarHBondContact O-N 2.97Å; F345-L349 HydrophobicContact CD1-CB 4.08Å; F345-L349 HydrophobicContact CD2-CD1 3.88Å; F345-L349 HydrophobicContact CE1-CB 4.09Å; F345-L349 HydrophobicContact CE2-CD1 4.08Å; F345-L349 HydrophobicContact CG-CB 4.27Å; F345-L349 HydrophobicContact CG-CD1 4.25Å; F345-L349 HydrophobicContact CZ-CB 4.34Å; F345-L349 WeakPolarHBondContact O-CA 3.49Å; F345-L349 WeakPolarHBondContact O-CB 3.47Å; F345-L349 PolarHBondContact O-N 2.93Å; F345-S350 PolarHBondContact O-N 3.5Å; F345-L353 HydrophobicContact CE1-CB 4.45Å; F345-L353 HydrophobicContact CE1-CD2 3.78Å; F345-L353 HydrophobicContact CZ-CD2 3.93Å; F345-I362 HydrophobicContact CE2-CD1 4.32Å; F345-I362 HydrophobicContact CE2-CG1 4.48Å; F345-I362 HydrophobicContact CE2-CG2 4.13Å; F345-I362 HydrophobicContact CZ-CD1 3.91Å; F345-I362 HydrophobicContact CZ-CG1 4.48Å; F345-F376 HydrophobicContact CB-CD2 4.2Å; F345-F376 HydrophobicContact CB-CE2 4.06Å; F345-F376 HydrophobicContact CD1-CD2 4.04Å; F345-F376 AromaticContact CD1-CE2 3.78Å; F345-F376 HydrophobicContact CD1-CE2 3.78Å; F345-F376 AromaticContact CD2-CE2 3.97Å; F345-F376 HydrophobicContact CD2-CE2 3.97Å; F345-F376 HydrophobicContact CE1-CE2 4.27Å; F345-F376 HydrophobicContact CE2-CE2 4.41Å; F345-F376 HydrophobicContact CG-CD2 4.13Å; F345-F376 AromaticContact CG-CE2 3.67Å; F345-F376 HydrophobicContact CG-CE2 3.67Å; F345-L379 HydrophobicContact CD1-CD2 3.85Å; F345-L379 HydrophobicContact CE1-CD2 3.84Å
346	V	93.5	Very high	87.8	Confident	39 Å²	39	39 Å²	39	24%	0.236	19%	0.194	C	C	.	.	H	α-helix	trans	-62.4	-41.8	178.5	173.8	0	0	0	0	110.7	S342 D343 S350 E375 F376 L379	S342-V346 WeakPolarHBondContact O-CG2 3.46Å; S342-V346 PolarHBondContact O-N 2.65Å; S342-V346 VanDerWaalsContact O-N 3.13Å; D343-V346 PolarHBondContact O-N 3.06Å; D343-V346 VanDerWaalsContact O-N 3.14Å; V346-S350 WeakPolarHBondContact O-CB 3.41Å; V346-S350 PolarHBondContact O-OG 2.89Å; V346-E375 HydrophobicContact CG1-CB 4.31Å; V346-E375 HydrophobicContact CG2-CB 4.47Å; V346-F376 HydrophobicContact CG2-CB 3.78Å; V346-F376 HydrophobicContact CG2-CD2 4.2Å; V346-L379 HydrophobicContact CG2-CD2 4.12Å
347	E	90.7	Very high	86.8	Confident	137 Å²	137	39.2 Å²	39.2	64%	0.64	20%	0.198	S	C	*	.	H	α-helix	trans	-66.6	-44.4	-179	-164.9	-177.8	153.8	0	0	113.2	D343 F345	D343-E347 PolarHBondContact O-N 3.48Å; F345-E347 VanDerWaalsContact C-N 3.32Å; F345-E347 PolarHBondContact O-N 2.97Å
348	H	87.8	Confident	86.1	Confident	60 Å²	60	43.1 Å²	43.1	28%	0.278	22%	0.215	S	C	.	.	H	α-helix	trans	-112.6	-23.4	-168.8	-52.3	-47.4	0	0	0	115.5	L325 L344	L325-H348 HydrophobicContact CD1-CB 4.12Å; L325-H348 HydrophobicContact CD2-CB 4.27Å; L344-H348 WeakPolarHBondContact CD2-NE2 3.3Å; L344-H348 WeakPolarHBondContact O-CB 3.31Å; L344-H348 PolarHBondContact O-CD2 2.8Å; L344-H348 VanDerWaalsContact O-CD2 3.31Å; L344-H348 PolarHBondContact O-N 3.28Å
349	L	89.9	Confident	86	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-13.7	-172.9	-59.3	-178.6	0	0	0	114.3	V288 L325 I338 F345 I351 L352 L353	V288-L349 HydrophobicContact CB-CD1 4.47Å; V288-L349 HydrophobicContact CG1-CD1 3.65Å; V288-L349 HydrophobicContact CG2-CD1 3.97Å; L325-L349 HydrophobicContact CD1-CD1 3.66Å; L325-L349 HydrophobicContact CD1-CD2 4Å; L325-L349 HydrophobicContact CD1-CG 3.61Å; I338-L349 HydrophobicContact CG2-CD1 4.48Å; F345-L349 HydrophobicContact CD1-CB 4.08Å; F345-L349 HydrophobicContact CD2-CD1 3.88Å; F345-L349 HydrophobicContact CE1-CB 4.09Å; F345-L349 HydrophobicContact CE2-CD1 4.08Å; F345-L349 HydrophobicContact CG-CB 4.27Å; F345-L349 HydrophobicContact CG-CD1 4.25Å; F345-L349 HydrophobicContact CZ-CB 4.34Å; F345-L349 WeakPolarHBondContact O-CA 3.49Å; F345-L349 WeakPolarHBondContact O-CB 3.47Å; F345-L349 PolarHBondContact O-N 2.93Å; L349-I351 PolarHBondContact O-N 3.32Å; L349-L352 HydrophobicContact CD2-CD1 3.98Å; L349-L352 PolarHBondContact O-N 2.84Å; L349-L352 VanDerWaalsContact O-N 3.09Å; L349-L353 WeakPolarHBondContact O-CB 3.38Å; L349-L353 PolarHBondContact O-N 2.82Å
350	S	90.2	Very high	85.6	Confident	29 Å²	29	43.6 Å²	43.6	20%	0.203	22%	0.217	C	C	.	.	H	α-helix	trans	-52.5	-47.8	-178.6	54	0	0	0	0	113.8	F345 V346 M354	F345-S350 PolarHBondContact O-N 3.5Å; V346-S350 WeakPolarHBondContact O-CB 3.41Å; V346-S350 PolarHBondContact O-OG 2.89Å; S350-M354 WeakPolarHBondContact O-CG 3.46Å; S350-M354 PolarHBondContact O-N 2.83Å; S350-M354 VanDerWaalsContact O-N 3.09Å
351	I	84.8	Confident	85.5	Confident	120 Å²	120	43.6 Å²	43.6	62%	0.615	22%	0.217	S	C	*	.	H	α-helix	trans	-68.2	-35.6	178.7	-61.1	173.2	0	0	0	111.8	L349 R355	L349-I351 PolarHBondContact O-N 3.32Å; I351-R355 WeakPolarHBondContact O-CB 3.25Å; I351-R355 VanDerWaalsContact O-CG 3.29Å; I351-R355 WeakPolarHBondContact O-CG 3.33Å; I351-R355 PolarHBondContact O-N 3.44Å
352	L	84	Confident	85.6	Confident	40 Å²	40	42.7 Å²	42.7	21%	0.209	21%	0.212	C	C	.	.	H	α-helix	trans	-71.1	-45.5	178.2	-67.3	170.7	0	0	0	110.8	W286 L332 L349 M354 R355 A357	W286-L352 HydrophobicContact CZ3-CD1 4.41Å; L332-L352 HydrophobicContact CD1-CD1 4.04Å; L349-L352 HydrophobicContact CD2-CD1 3.98Å; L349-L352 PolarHBondContact O-N 2.84Å; L349-L352 VanDerWaalsContact O-N 3.09Å; L352-M354 PolarHBondContact O-N 2.86Å; L352-R355 PolarHBondContact O-N 3.37Å; L352-R355 VanDerWaalsContact O-N 3.11Å; L352-A357 HydrophobicContact CB-CB 4.34Å; L352-A357 HydrophobicContact CD2-CB 4.1Å; L352-A357 WeakPolarHBondContact O-CB 3.28Å; L352-A357 PolarHBondContact O-N 3.38Å
353	L	87.9	Confident	85.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-56.4	-51.3	176.2	-179	68.3	0	0	0	111.4	F345 L349 R355 Q356 I359 I362 L379 Y383	F345-L353 HydrophobicContact CE1-CB 4.45Å; F345-L353 HydrophobicContact CE1-CD2 3.78Å; F345-L353 HydrophobicContact CZ-CD2 3.93Å; L349-L353 WeakPolarHBondContact O-CB 3.38Å; L349-L353 PolarHBondContact O-N 2.82Å; L353-R355 PolarHBondContact O-N 3.49Å; L353-R355 VanDerWaalsContact O-N 3.14Å; L353-Q356 PolarHBondContact O-N 2.82Å; L353-I359 HydrophobicContact CB-CD1 4.22Å; L353-I359 HydrophobicContact CD1-CD1 4Å; L353-I359 HydrophobicContact CD1-CG2 4.4Å; L353-I362 HydrophobicContact CD1-CD1 3.8Å; L353-I362 HydrophobicContact CD2-CD1 4.23Å; L353-L379 HydrophobicContact CD2-CD1 4.42Å; L353-L379 HydrophobicContact CD2-CG 4.21Å; L353-Y383 HydrophobicContact CD1-CD1 4.14Å; L353-Y383 HydrophobicContact CD1-CD2 3.86Å; L353-Y383 HydrophobicContact CD1-CE1 3.74Å; L353-Y383 HydrophobicContact CD1-CE2 3.45Å; L353-Y383 VanDerWaalsContact CD1-CE2 3.45Å; L353-Y383 HydrophobicContact CD1-CG 4.18Å; L353-Y383 HydrophobicContact CD2-CD1 4.3Å; L353-Y383 HydrophobicContact CD2-CD2 4.01Å; L353-Y383 HydrophobicContact CD2-CE2 4.46Å; L353-Y383 HydrophobicContact CD2-CG 3.91Å; L353-Y383 HydrophobicContact CG-CD1 4.4Å; L353-Y383 HydrophobicContact CG-CD2 3.56Å; L353-Y383 HydrophobicContact CG-CE1 4.43Å; L353-Y383 HydrophobicContact CG-CE2 3.62Å; L353-Y383 HydrophobicContact CG-CG 3.96Å; L353-Y383 VanDerWaalsContact O-CE2 3.3Å; L353-Y383 WeakPolarHBondContact O-CE2 3.44Å
354	M	85.8	Confident	85.7	Confident	57 Å²	57	37.9 Å²	37.9	28%	0.281	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-5.7	-179.3	-66.7	-56.7	-57	0	0	114.1	S350 L352 L379 Y383 H386 F387	S350-M354 WeakPolarHBondContact O-CG 3.46Å; S350-M354 PolarHBondContact O-N 2.83Å; S350-M354 VanDerWaalsContact O-N 3.09Å; L352-M354 PolarHBondContact O-N 2.86Å; M354-L379 HydrophobicContact CG-CD1 4.1Å; M354-L379 HydrophobicContact SD-CD1 4.39Å; M354-Y383 HydrophobicContact SD-CD2 4.03Å; M354-H386 HydrophobicContact CE-CB 3.84Å; M354-F387 HydrophobicContact CE-CE2 4.06Å; M354-F387 HydrophobicContact SD-CE2 4.4Å
355	R	74.7	Confident	85.7	Confident	132 Å²	132	36.2 Å²	36.2	50%	0.498	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	9.7	171.4	-75.1	178.1	166.9	-151	-8.3	113.6	I351 L352 L353 A357	I351-R355 WeakPolarHBondContact O-CB 3.25Å; I351-R355 VanDerWaalsContact O-CG 3.29Å; I351-R355 WeakPolarHBondContact O-CG 3.33Å; I351-R355 PolarHBondContact O-N 3.44Å; L352-R355 PolarHBondContact O-N 3.37Å; L352-R355 VanDerWaalsContact O-N 3.11Å; L353-R355 PolarHBondContact O-N 3.49Å; L353-R355 VanDerWaalsContact O-N 3.14Å; R355-A357 HydrophobicContact CB-CB 4.14Å; R355-A357 PolarHBondContact O-N 3.04Å
356	Q	67.7	Low	85.5	Confident	30 Å²	30	37.9 Å²	37.9	14%	0.14	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	18.8	-168.3	-56.5	169.5	-79.2	0	0	113.1	H45 L353 F358 F387 N392	H45-Q356 VanDerWaalsContact CA-OE1 3.31Å; H45-Q356 PolarHBondContact ND1-OE1 2.94Å; H45-Q356 VanDerWaalsContact ND1-OE1 3.16Å; L353-Q356 PolarHBondContact O-N 2.82Å; Q356-F358 PolarHBondContact O-N 3.3Å; Q356-F387 VanDerWaalsContact CD-CE1 3.41Å; Q356-F387 HydrophobicContact CG-CD1 3.8Å; Q356-F387 HydrophobicContact CG-CE1 3.27Å; Q356-F387 HydrophobicContact CG-CE2 4.47Å; Q356-F387 HydrophobicContact CG-CZ 3.68Å; Q356-N392 PolarHBondContact NE2-O 2.8Å
357	A	63.4	Low	85.5	Confident	18 Å²	18	36.3 Å²	36.3	15%	0.149	18%	0.176	C	C	.	.			trans	-78.1	100.4	-167.3	0	0	0	0	0	110.6	L352 R355 I359	L352-A357 HydrophobicContact CB-CB 4.34Å; L352-A357 HydrophobicContact CD2-CB 4.1Å; L352-A357 WeakPolarHBondContact O-CB 3.28Å; L352-A357 PolarHBondContact O-N 3.38Å; R355-A357 HydrophobicContact CB-CB 4.14Å; R355-A357 PolarHBondContact O-N 3.04Å; A357-I359 PolarHBondContact O-N 3.49Å
358	F	71.9	Confident	85.5	Confident	81 Å²	81	31.6 Å²	31.6	36%	0.355	16%	0.164	S	C	.	.	S	Bend	trans	60.9	33.1	166.5	-44.7	-77.2	0	0	0	115.7	S282 T285 W286 Q356	S282-F358 WeakPolarHBondContact O-CE1 3.46Å; T285-F358 CarbonylContact C-O 3.59Å; W286-F358 WeakPolarHBondContact CB-O 2.99Å; W286-F358 HydrophobicContact CD2-CB 3.81Å; W286-F358 VanDerWaalsContact CD2-O 3.31Å; W286-F358 HydrophobicContact CE3-CB 3.89Å; W286-F358 HydrophobicContact CH2-CB 3.69Å; W286-F358 AromaticContact CH2-CD2 3.76Å; W286-F358 HydrophobicContact CH2-CD2 3.76Å; W286-F358 HydrophobicContact CH2-CG 4.01Å; W286-F358 HydrophobicContact CZ2-CB 3.58Å; W286-F358 AromaticContact CZ2-CD2 4Å; W286-F358 HydrophobicContact CZ2-CD2 4Å; W286-F358 AromaticContact CZ2-CG 3.87Å; W286-F358 HydrophobicContact CZ2-CG 3.87Å; W286-F358 HydrophobicContact CZ3-CB 3.85Å; W286-F358 HydrophobicContact CZ3-CD2 4.45Å; W286-F358 PolarHBondContact N-O 3.44Å; Q356-F358 PolarHBondContact O-N 3.3Å
359	I	85.3	Confident	85.5	Confident	11 Å²	11	32.3 Å²	32.3	6%	0.056	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	112.7	174.3	-61.3	174.2	0	0	0	110.4	W286 V288 L353 A357 I362	W286-I359 HydrophobicContact CE3-CG1 4.46Å; W286-I359 WeakPolarHBondContact O-CA 3.43Å; V288-I359 HydrophobicContact CG2-CD1 4.01Å; V288-I359 HydrophobicContact CG2-CG1 4.12Å; V288-I359 HydrophobicContact CG2-CG2 4.29Å; L353-I359 HydrophobicContact CB-CD1 4.22Å; L353-I359 HydrophobicContact CD1-CD1 4Å; L353-I359 HydrophobicContact CD1-CG2 4.4Å; A357-I359 PolarHBondContact O-N 3.49Å; I359-I362 HydrophobicContact CG2-CG1 4.03Å
360	C	82.7	Confident	85.7	Confident	2 Å²	2	32.5 Å²	32.5	1%	0.014	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-13.7	174	68.3	0	0	0	0	114	L50 N270 T285 W286 G394 R395	L50-C360 HydrophobicContact CD2-CB 4.12Å; N270-C360 WeakPolarHBondContact ND2-CB 3.48Å; T285-C360 PolarHBondContact O-SG 3.2Å; T285-C360 WeakPolarHBondContact OG1-CB 3.39Å; W286-C360 PolarHBondContact O-N 3.33Å; C360-G394 VanDerWaalsContact C-CA 3.43Å; C360-G394 VanDerWaalsContact O-CA 3.25Å; C360-G394 WeakPolarHBondContact O-CA 3.43Å; C360-R395 PolarHBondContact O-N 3Å; C360-R395 VanDerWaalsContact O-N 3.07Å
361	G	89.6	Confident	85.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	143.4	-179	0	0	0	0	0	113.4	V287 V288 R395	V287-G361 WeakPolarHBondContact CA-O 3.3Å; V288-G361 PolarHBondContact N-O 2.94Å; G361-R395 WeakPolarHBondContact CA-O 3.35Å
362	I	94	Very high	86.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	115.2	170.4	-52.4	176.6	0	0	0	107.4	V288 V290 F345 L353 I359 I364 L380 R395 I396 I397	V288-I362 CarbonylContact O-C 3.49Å; V288-I362 WeakPolarHBondContact O-CA 3.32Å; V290-I362 HydrophobicContact CG2-CG2 4.17Å; F345-I362 HydrophobicContact CE2-CD1 4.32Å; F345-I362 HydrophobicContact CE2-CG1 4.48Å; F345-I362 HydrophobicContact CE2-CG2 4.13Å; F345-I362 HydrophobicContact CZ-CD1 3.91Å; F345-I362 HydrophobicContact CZ-CG1 4.48Å; L353-I362 HydrophobicContact CD1-CD1 3.8Å; L353-I362 HydrophobicContact CD2-CD1 4.23Å; I359-I362 HydrophobicContact CG2-CG1 4.03Å; I362-I364 HydrophobicContact CG2-CD1 4.3Å; I362-I364 HydrophobicContact CG2-CG1 4.07Å; I362-L380 HydrophobicContact CD1-CD2 3.9Å; I362-R395 PolarHBondContact N-O 3.08Å; I362-I396 HydrophobicContact CB-CG2 4.37Å; I362-I396 HydrophobicContact CD1-CG1 4.43Å; I362-I396 WeakPolarHBondContact O-CA 3.45Å; I362-I397 PolarHBondContact O-N 3.3Å
363	I	94.5	Very high	86.7	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	121.2	176.9	-58	-177.3	0	0	0	109	A259 L262 A263 V287 V288 W289 V290 I397 F399	A259-I363 HydrophobicContact CB-CG2 3.97Å; A259-I363 WeakPolarHBondContact O-CD1 3.46Å; L262-I363 HydrophobicContact CB-CD1 4.39Å; A263-I363 HydrophobicContact CB-CD1 3.85Å; V287-I363 HydrophobicContact CG1-CD1 3.86Å; V287-I363 HydrophobicContact CG1-CG1 3.97Å; V288-I363 PolarHBondContact O-N 2.56Å; W289-I363 CarbonylContact C-O 3.6Å; W289-I363 WeakPolarHBondContact CA-O 3.07Å; W289-I363 HydrophobicContact CB-CB 4.39Å; W289-I363 HydrophobicContact CD2-CG2 4.46Å; W289-I363 HydrophobicContact CG-CB 4.13Å; W289-I363 HydrophobicContact CG-CG2 4.2Å; V290-I363 PolarHBondContact N-O 3.36Å; I363-I397 CarbonylContact C-O 3.57Å; I363-I397 VanDerWaalsContact CA-O 3.27Å; I363-I397 WeakPolarHBondContact CA-O 3.49Å; I363-F399 HydrophobicContact CG2-CD2 4.49Å; I363-F399 HydrophobicContact CG2-CE2 3.86Å
364	I	95.5	Very high	86.9	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	107.5	-177.3	-64.3	168.4	0	0	0	108.4	V290 I362 D366 A370 F376 L380 I396 I397 C398 F399 F410	V290-I364 HydrophobicContact CB-CG1 4.24Å; V290-I364 HydrophobicContact CG2-CG1 4.26Å; I362-I364 HydrophobicContact CG2-CD1 4.3Å; I362-I364 HydrophobicContact CG2-CG1 4.07Å; I364-D366 VanDerWaalsContact C-N 3.27Å; I364-D366 PolarHBondContact O-N 2.79Å; I364-A370 HydrophobicContact CG2-CB 3.66Å; I364-F376 HydrophobicContact CD1-CE1 3.82Å; I364-F376 HydrophobicContact CD1-CZ 3.81Å; I364-F376 HydrophobicContact CG1-CE1 4.3Å; I364-F376 HydrophobicContact CG1-CZ 4.14Å; I364-L380 HydrophobicContact CD1-CD1 3.61Å; I364-I396 HydrophobicContact CD1-CG2 3.93Å; I364-I397 PolarHBondContact N-O 3.33Å; I364-C398 HydrophobicContact CB-CB 4.14Å; I364-C398 CarbonylContact O-C 3.47Å; I364-C398 WeakPolarHBondContact O-CA 3.32Å; I364-F399 PolarHBondContact O-N 3.11Å; I364-F410 HydrophobicContact CD1-CE1 3.87Å; I364-F410 HydrophobicContact CD1-CZ 4.1Å
365	H	91.9	Very high	87.4	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.005	22%	0.216	C	C	.	.	S	Bend	trans	-66.6	-23.4	-171.1	179.9	96.6	0	0	0	114.1	F252 R255 D256 V290 L291 F399	F252-H365 AromaticContact CD2-NE2 3.71Å; F252-H365 AromaticContact CE2-CE1 3.76Å; F252-H365 AromaticContact CE2-NE2 3.01Å; F252-H365 WeakPolarHBondContact CE2-NE2 3.46Å; F252-H365 AromaticContact CZ-CE1 3.79Å; F252-H365 AromaticContact CZ-NE2 3.41Å; F252-H365 WeakPolarHBondContact CZ-NE2 3.44Å; R255-H365 PolarHBondContact NH1-O 3.42Å; D256-H365 IonicContact OD1-CE1 3.29Å; D256-H365 PolarHBondContact OD1-CE1 3.34Å; D256-H365 IonicContact OD1-ND1 2.77Å; D256-H365 PolarHBondContact OD1-ND1 2.82Å; D256-H365 VanDerWaalsContact OD1-ND1 3.14Å; V290-H365 WeakPolarHBondContact O-CB 2.97Å; V290-H365 PolarHBondContact O-N 2.78Å; L291-H365 HydrophobicContact CD2-CB 4.28Å; H365-F399 WeakPolarHBondContact O-CB 3.4Å
366	D	90.8	Very high	88.4	Confident	36 Å²	36	37.4 Å²	37.4	19%	0.193	19%	0.192	C	C	.	.			trans	-151.7	119.3	173.1	-165.1	-80.8	0	0	0	112.6	R255 I364 G368 L369 A370 F399	R255-D366 IonicContact CZ-OD2 3.14Å; R255-D366 IonicContact NH1-OD2 3.07Å; R255-D366 PolarHBondContact NH1-OD2 2.66Å; R255-D366 IonicContact NH2-OD2 2.99Å; I364-D366 VanDerWaalsContact C-N 3.27Å; I364-D366 PolarHBondContact O-N 2.79Å; D366-G368 VanDerWaalsContact OD1-CA 3.32Å; D366-G368 WeakPolarHBondContact OD1-CA 3.2Å; D366-G368 PolarHBondContact OD1-N 3.35Å; D366-L369 HydrophobicContact CB-CB 4.27Å; D366-L369 HydrophobicContact CB-CD1 4.25Å; D366-L369 HydrophobicContact CB-CG 4.24Å; D366-L369 PolarHBondContact OD1-N 2.91Å; D366-A370 WeakPolarHBondContact O-CB 3.49Å; D366-A370 PolarHBondContact O-N 3.06Å; D366-F399 CarbonylContact C-O 3.6Å; D366-F399 WeakPolarHBondContact CA-O 3.37Å
367	V	92.6	Very high	89.7	Confident	6 Å²	6	37 Å²	37	4%	0.036	19%	0.192	C	C	.	.	H	α-helix	trans	-63.8	-42.5	176.7	171.1	0	0	0	0	112	V246 L369 A370 L371 C398 F399 V404 F410	V246-V367 HydrophobicContact CG1-CG2 4.19Å; V367-L369 PolarHBondContact O-N 3.36Å; V367-A370 PolarHBondContact O-N 3.29Å; V367-A370 VanDerWaalsContact O-N 3.15Å; V367-L371 HydrophobicContact CG1-CD1 3.79Å; V367-L371 HydrophobicContact CG1-CG 4.09Å; V367-L371 WeakPolarHBondContact O-CB 3.48Å; V367-L371 VanDerWaalsContact O-CG 3.28Å; V367-L371 WeakPolarHBondContact O-CG 3.18Å; V367-L371 PolarHBondContact O-N 3.01Å; V367-C398 HydrophobicContact CG2-CB 3.39Å; V367-F399 WeakPolarHBondContact CG2-O 3.23Å; V367-F399 PolarHBondContact N-O 3.21Å; V367-V404 HydrophobicContact CG1-CG1 4.47Å; V367-V404 HydrophobicContact CG1-CG2 4.07Å; V367-F410 HydrophobicContact CG1-CB 4.3Å; V367-F410 HydrophobicContact CG1-CD2 3.71Å; V367-F410 HydrophobicContact CG1-CE2 4.31Å; V367-F410 HydrophobicContact CG1-CG 4.15Å
368	G	90.6	Very high	91.2	Very high	38 Å²	38	39.6 Å²	39.6	39%	0.392	20%	0.2	S	C	.	.	H	α-helix	trans	-67.8	-19.4	-177.1	0	0	0	0	0	113.7	D366 K372	D366-G368 VanDerWaalsContact OD1-CA 3.32Å; D366-G368 WeakPolarHBondContact OD1-CA 3.2Å; D366-G368 PolarHBondContact OD1-N 3.35Å; G368-K372 WeakPolarHBondContact O-CE 3.32Å
369	L	88.8	Confident	92.3	Very high	75 Å²	75	36.4 Å²	36.4	39%	0.393	19%	0.187	S	C	.	.	H	α-helix	trans	-90	-39.8	167.7	-61.8	-178.7	0	0	0	112.6	P292 D366 V367 L371 K372	P292-L369 HydrophobicContact CB-CD1 3.62Å; P292-L369 HydrophobicContact CG-CD1 3.96Å; D366-L369 HydrophobicContact CB-CB 4.27Å; D366-L369 HydrophobicContact CB-CD1 4.25Å; D366-L369 HydrophobicContact CB-CG 4.24Å; D366-L369 PolarHBondContact OD1-N 2.91Å; V367-L369 PolarHBondContact O-N 3.36Å; L369-L371 VanDerWaalsContact C-N 3.29Å; L369-L371 PolarHBondContact O-N 2.75Å; L369-K372 HydrophobicContact CD2-CD 4.23Å; L369-K372 WeakPolarHBondContact O-CB 3.46Å; L369-K372 PolarHBondContact O-N 3.31Å; L369-K372 VanDerWaalsContact O-N 3.08Å
370	A	92.6	Very high	92.7	Very high	5 Å²	5	35.9 Å²	35.9	4%	0.041	18%	0.184	C	C	.	.	H	α-helix	trans	-59.4	-38.9	176.5	0	0	0	0	0	112.6	I364 D366 V367 K372 N373 F376 C377 F410	I364-A370 HydrophobicContact CG2-CB 3.66Å; D366-A370 WeakPolarHBondContact O-CB 3.49Å; D366-A370 PolarHBondContact O-N 3.06Å; V367-A370 PolarHBondContact O-N 3.29Å; V367-A370 VanDerWaalsContact O-N 3.15Å; A370-K372 PolarHBondContact O-N 2.58Å; A370-K372 VanDerWaalsContact O-N 3.14Å; A370-N373 PolarHBondContact O-N 3.23Å; A370-N373 VanDerWaalsContact O-N 3.1Å; A370-F376 HydrophobicContact CB-CD1 4.28Å; A370-F376 HydrophobicContact CB-CE1 4.09Å; A370-C377 PolarHBondContact O-SG 3.19Å; A370-C377 VanDerWaalsContact O-SG 3.34Å; A370-F410 HydrophobicContact CB-CE2 4.21Å; A370-F410 HydrophobicContact CB-CZ 4.15Å
371	L	92.6	Very high	93.1	Very high	74 Å²	74	41.8 Å²	41.8	39%	0.387	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-20.8	175.5	-75.4	170.8	0	0	0	114.1	V367 L369 N373 F410	V367-L371 HydrophobicContact CG1-CD1 3.79Å; V367-L371 HydrophobicContact CG1-CG 4.09Å; V367-L371 WeakPolarHBondContact O-CB 3.48Å; V367-L371 VanDerWaalsContact O-CG 3.28Å; V367-L371 WeakPolarHBondContact O-CG 3.18Å; V367-L371 PolarHBondContact O-N 3.01Å; L369-L371 VanDerWaalsContact C-N 3.29Å; L369-L371 PolarHBondContact O-N 2.75Å; L371-N373 VanDerWaalsContact C-N 3.33Å; L371-F410 HydrophobicContact CD2-CD2 3.82Å; L371-F410 HydrophobicContact CD2-CE2 4.01Å; L371-F410 HydrophobicContact CG-CD2 4.14Å; L371-F410 HydrophobicContact CG-CE2 4.2Å
372	K	92.7	Very high	93.3	Very high	163 Å²	163	49 Å²	49	71%	0.709	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-14.9	178.7	-60.3	177.8	-178.6	177.5	0	113.2	G368 L369 A370	G368-K372 WeakPolarHBondContact O-CE 3.32Å; L369-K372 HydrophobicContact CD2-CD 4.23Å; L369-K372 WeakPolarHBondContact O-CB 3.46Å; L369-K372 PolarHBondContact O-N 3.31Å; L369-K372 VanDerWaalsContact O-N 3.08Å; A370-K372 PolarHBondContact O-N 2.58Å; A370-K372 VanDerWaalsContact O-N 3.14Å
373	N	94.3	Very high	93.1	Very high	26 Å²	26	49.1 Å²	49.1	14%	0.139	24%	0.235	C	C	.	.			trans	-102.8	97.1	171.3	-174.6	-39.8	0	0	0	109	D343 A370 L371 E375 F376 C377	D343-N373 PolarHBondContact OD1-ND2 3.1Å; A370-N373 PolarHBondContact O-N 3.23Å; A370-N373 VanDerWaalsContact O-N 3.1Å; L371-N373 VanDerWaalsContact C-N 3.33Å; N373-E375 VanDerWaalsContact C-N 3.35Å; N373-E375 PolarHBondContact O-N 3.37Å; N373-E375 PolarHBondContact OD1-N 3.29Å; N373-F376 HydrophobicContact CB-CB 3.99Å; N373-F376 PolarHBondContact O-N 2.91Å; N373-F376 WeakPolarHBondContact OD1-CB 3.4Å; N373-F376 PolarHBondContact OD1-N 3.31Å; N373-C377 PolarHBondContact O-N 3.01Å; N373-C377 VanDerWaalsContact O-N 3.1Å; N373-C377 PolarHBondContact O-SG 3.28Å; N373-C377 VanDerWaalsContact O-SG 3.4Å
374	E	93.8	Very high	92.9	Very high	127 Å²	127	51.3 Å²	51.3	59%	0.593	24%	0.243	S	C	*	.	H	α-helix	trans	-58.5	-42.2	179.3	-75.2	-171.5	-152.2	0	0	113.1	F376 C377 K378	E374-F376 VanDerWaalsContact C-N 3.34Å; E374-F376 PolarHBondContact O-N 3.01Å; E374-C377 PolarHBondContact O-N 3.22Å; E374-K378 HydrophobicContact CB-CD 4.5Å; E374-K378 WeakPolarHBondContact O-CB 2.9Å; E374-K378 WeakPolarHBondContact O-CD 3.46Å; E374-K378 WeakPolarHBondContact O-CG 3.37Å; E374-K378 PolarHBondContact O-N 3.27Å; E374-K378 WeakPolarHBondContact OE2-CE 3.45Å; E374-K378 IonicContact OE2-NZ 3.61Å; E374-K378 PolarHBondContact OE2-NZ 3.38Å
375	E	95.7	Very high	92.6	Very high	91 Å²	91	56.4 Å²	56.4	43%	0.425	27%	0.267	S	S	.	.	H	α-helix	trans	-68.6	-34.8	-176.6	-66.1	-51.2	120.6	0	0	111.8	V346 N373 K378 L379	V346-E375 HydrophobicContact CG1-CB 4.31Å; V346-E375 HydrophobicContact CG2-CB 4.47Å; N373-E375 VanDerWaalsContact C-N 3.35Å; N373-E375 PolarHBondContact O-N 3.37Å; N373-E375 PolarHBondContact OD1-N 3.29Å; E375-K378 PolarHBondContact O-N 2.69Å; E375-K378 VanDerWaalsContact OE1-CD 3.23Å; E375-K378 WeakPolarHBondContact OE1-CD 3.45Å; E375-K378 WeakPolarHBondContact OE1-CE 3.47Å; E375-K378 IonicContact OE1-NZ 2.7Å; E375-K378 PolarHBondContact OE1-NZ 3.07Å; E375-L379 WeakPolarHBondContact O-CB 3.41Å; E375-L379 PolarHBondContact O-N 2.88Å
376	F	96	Very high	92.4	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.3	-44.2	170.3	-178.6	-114.1	0	0	0	111.1	V290 F345 V346 I364 A370 N373 E374 L379 L380	V290-F376 HydrophobicContact CB-CZ 4.48Å; V290-F376 HydrophobicContact CG1-CE1 4.46Å; V290-F376 HydrophobicContact CG1-CZ 4.22Å; V290-F376 HydrophobicContact CG2-CE2 4.3Å; V290-F376 HydrophobicContact CG2-CZ 3.88Å; F345-F376 HydrophobicContact CB-CD2 4.2Å; F345-F376 HydrophobicContact CB-CE2 4.06Å; F345-F376 HydrophobicContact CD1-CD2 4.04Å; F345-F376 AromaticContact CD1-CE2 3.78Å; F345-F376 HydrophobicContact CD1-CE2 3.78Å; F345-F376 AromaticContact CD2-CE2 3.97Å; F345-F376 HydrophobicContact CD2-CE2 3.97Å; F345-F376 HydrophobicContact CE1-CE2 4.27Å; F345-F376 HydrophobicContact CE2-CE2 4.41Å; F345-F376 HydrophobicContact CG-CD2 4.13Å; F345-F376 AromaticContact CG-CE2 3.67Å; F345-F376 HydrophobicContact CG-CE2 3.67Å; V346-F376 HydrophobicContact CG2-CB 3.78Å; V346-F376 HydrophobicContact CG2-CD2 4.2Å; I364-F376 HydrophobicContact CD1-CE1 3.82Å; I364-F376 HydrophobicContact CD1-CZ 3.81Å; I364-F376 HydrophobicContact CG1-CE1 4.3Å; I364-F376 HydrophobicContact CG1-CZ 4.14Å; A370-F376 HydrophobicContact CB-CD1 4.28Å; A370-F376 HydrophobicContact CB-CE1 4.09Å; N373-F376 HydrophobicContact CB-CB 3.99Å; N373-F376 PolarHBondContact O-N 2.91Å; N373-F376 WeakPolarHBondContact OD1-CB 3.4Å; N373-F376 PolarHBondContact OD1-N 3.31Å; E374-F376 VanDerWaalsContact C-N 3.34Å; E374-F376 PolarHBondContact O-N 3.01Å; F376-L379 WeakPolarHBondContact O-CB 3.28Å; F376-L379 PolarHBondContact O-N 3.36Å; F376-L380 HydrophobicContact CD1-CD1 4.25Å; F376-L380 HydrophobicContact CE1-CD1 3.71Å; F376-L380 HydrophobicContact CE1-CG 4.45Å; F376-L380 HydrophobicContact CE2-CD1 4.34Å; F376-L380 HydrophobicContact CE2-CD2 4.28Å; F376-L380 HydrophobicContact CE2-CG 4.29Å; F376-L380 HydrophobicContact CZ-CD1 3.75Å; F376-L380 HydrophobicContact CZ-CD2 4.29Å; F376-L380 HydrophobicContact CZ-CG 4.19Å; F376-L380 WeakPolarHBondContact O-CG 2.91Å; F376-L380 PolarHBondContact O-N 3.37Å
377	C	94.7	Very high	92.1	Very high	20 Å²	20	60 Å²	60	14%	0.135	28%	0.282	C	S	.	.	H	α-helix	trans	-64.2	-42.7	175.7	-67.2	0	0	0	0	112.6	A370 N373 E374 L379 L380 Y381 V409	A370-C377 PolarHBondContact O-SG 3.19Å; A370-C377 VanDerWaalsContact O-SG 3.34Å; N373-C377 PolarHBondContact O-N 3.01Å; N373-C377 VanDerWaalsContact O-N 3.1Å; N373-C377 PolarHBondContact O-SG 3.28Å; N373-C377 VanDerWaalsContact O-SG 3.4Å; E374-C377 PolarHBondContact O-N 3.22Å; C377-L379 VanDerWaalsContact C-N 3.34Å; C377-L379 PolarHBondContact O-N 2.93Å; C377-L380 PolarHBondContact O-N 3.37Å; C377-Y381 WeakPolarHBondContact O-CB 3.1Å; C377-Y381 PolarHBondContact O-N 3.47Å; C377-V409 HydrophobicContact CB-CG1 4.38Å
378	K	94.2	Very high	91.6	Very high	74 Å²	74	64.8 Å²	64.8	32%	0.322	31%	0.312	S	S	.	.	H	α-helix	trans	-62.8	-39	174.7	-69.7	160.9	-168.1	167.4	0	111.5	E374 E375 Y381 R382	E374-K378 HydrophobicContact CB-CD 4.5Å; E374-K378 WeakPolarHBondContact O-CB 2.9Å; E374-K378 WeakPolarHBondContact O-CD 3.46Å; E374-K378 WeakPolarHBondContact O-CG 3.37Å; E374-K378 PolarHBondContact O-N 3.27Å; E374-K378 WeakPolarHBondContact OE2-CE 3.45Å; E374-K378 IonicContact OE2-NZ 3.61Å; E374-K378 PolarHBondContact OE2-NZ 3.38Å; E375-K378 PolarHBondContact O-N 2.69Å; E375-K378 VanDerWaalsContact OE1-CD 3.23Å; E375-K378 WeakPolarHBondContact OE1-CD 3.45Å; E375-K378 WeakPolarHBondContact OE1-CE 3.47Å; E375-K378 IonicContact OE1-NZ 2.7Å; E375-K378 PolarHBondContact OE1-NZ 3.07Å; K378-Y381 PolarHBondContact O-N 3.27Å; K378-R382 WeakPolarHBondContact O-CB 3.45Å; K378-R382 VanDerWaalsContact O-CG 3.29Å; K378-R382 WeakPolarHBondContact O-CG 3.18Å; K378-R382 PolarHBondContact O-N 3.21Å
379	L	95	Very high	91.1	Very high	14 Å²	14	66.9 Å²	66.9	7%	0.073	31%	0.314	C	S	.	.	H	α-helix	trans	-63.8	-48.6	174.7	175.9	62.5	0	0	0	111.8	F345 V346 L353 M354 E375 F376 C377 Y381 R382 Y383	F345-L379 HydrophobicContact CD1-CD2 3.85Å; F345-L379 HydrophobicContact CE1-CD2 3.84Å; V346-L379 HydrophobicContact CG2-CD2 4.12Å; L353-L379 HydrophobicContact CD2-CD1 4.42Å; L353-L379 HydrophobicContact CD2-CG 4.21Å; M354-L379 HydrophobicContact CG-CD1 4.1Å; M354-L379 HydrophobicContact SD-CD1 4.39Å; E375-L379 WeakPolarHBondContact O-CB 3.41Å; E375-L379 PolarHBondContact O-N 2.88Å; F376-L379 WeakPolarHBondContact O-CB 3.28Å; F376-L379 PolarHBondContact O-N 3.36Å; C377-L379 VanDerWaalsContact C-N 3.34Å; C377-L379 PolarHBondContact O-N 2.93Å; L379-Y381 VanDerWaalsContact C-N 3.32Å; L379-Y381 PolarHBondContact O-N 3.37Å; L379-R382 PolarHBondContact O-N 3.48Å; L379-Y383 WeakPolarHBondContact O-CB 3.34Å; L379-Y383 PolarHBondContact O-N 3.26Å
380	L	93.8	Very high	90.5	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.1	-38	176.4	-65.4	-179.6	0	0	0	112.2	I362 I364 F376 C377 Y383 R384 I396 F410	I362-L380 HydrophobicContact CD1-CD2 3.9Å; I364-L380 HydrophobicContact CD1-CD1 3.61Å; F376-L380 HydrophobicContact CD1-CD1 4.25Å; F376-L380 HydrophobicContact CE1-CD1 3.71Å; F376-L380 HydrophobicContact CE1-CG 4.45Å; F376-L380 HydrophobicContact CE2-CD1 4.34Å; F376-L380 HydrophobicContact CE2-CD2 4.28Å; F376-L380 HydrophobicContact CE2-CG 4.29Å; F376-L380 HydrophobicContact CZ-CD1 3.75Å; F376-L380 HydrophobicContact CZ-CD2 4.29Å; F376-L380 HydrophobicContact CZ-CG 4.19Å; F376-L380 WeakPolarHBondContact O-CG 2.91Å; F376-L380 PolarHBondContact O-N 3.37Å; C377-L380 PolarHBondContact O-N 3.37Å; L380-Y383 PolarHBondContact O-N 3.1Å; L380-R384 WeakPolarHBondContact O-CG 3.47Å; L380-R384 PolarHBondContact O-N 3.36Å; L380-I396 HydrophobicContact CD2-CD1 4.24Å; L380-F410 HydrophobicContact CD1-CE1 3.86Å; L380-F410 HydrophobicContact CD1-CZ 3.84Å
381	Y	92.3	Very high	89.6	Confident	126 Å²	126	66.5 Å²	66.5	49%	0.494	31%	0.314	S	S	.	.	H	α-helix	trans	-62.9	-50.1	174.6	-176.6	-94.8	0	0	0	111.5	C377 K378 L379 Y383 R384 Q385 V409	C377-Y381 WeakPolarHBondContact O-CB 3.1Å; C377-Y381 PolarHBondContact O-N 3.47Å; K378-Y381 PolarHBondContact O-N 3.27Å; L379-Y381 VanDerWaalsContact C-N 3.32Å; L379-Y381 PolarHBondContact O-N 3.37Å; Y381-Y383 VanDerWaalsContact C-N 3.29Å; Y381-Y383 PolarHBondContact O-N 3.42Å; Y381-R384 PolarHBondContact O-N 3.18Å; Y381-Q385 HydrophobicContact CD1-CG 4.12Å; Y381-Q385 HydrophobicContact CE1-CG 3.73Å; Y381-Q385 HydrophobicContact CE2-CG 4.39Å; Y381-Q385 WeakPolarHBondContact O-CG 3.45Å; Y381-Q385 PolarHBondContact O-N 3.04Å; Y381-Q385 PolarHBondContact OH-NE2 2.94Å; Y381-Q385 VanDerWaalsContact OH-NE2 3.09Å; Y381-V409 HydrophobicContact CD2-CG2 4.21Å
382	R	92.3	Very high	88.6	Confident	152 Å²	152	64.2 Å²	64.2	57%	0.574	30%	0.302	S	S	*	.	H	α-helix	trans	-57.2	-41.3	174.8	-74	172.1	-176.6	156	3.8	112	K378 L379 Q385 H386	K378-R382 WeakPolarHBondContact O-CB 3.45Å; K378-R382 VanDerWaalsContact O-CG 3.29Å; K378-R382 WeakPolarHBondContact O-CG 3.18Å; K378-R382 PolarHBondContact O-N 3.21Å; L379-R382 PolarHBondContact O-N 3.48Å; R382-Q385 PolarHBondContact O-N 3.42Å; R382-H386 VanDerWaalsContact O-CB 3.31Å; R382-H386 WeakPolarHBondContact O-CB 3.46Å; R382-H386 PolarHBondContact O-N 3.31Å
383	Y	91.4	Very high	88.2	Confident	2 Å²	2	57 Å²	57	1%	0.008	27%	0.27	C	S	.	.	H	α-helix	trans	-60.2	-49.7	177.1	-175.3	-118.8	0	0	0	112.1	L353 M354 L379 L380 Y381 Q385 H386 F387 R393 G394 I396	L353-Y383 HydrophobicContact CD1-CD1 4.14Å; L353-Y383 HydrophobicContact CD1-CD2 3.86Å; L353-Y383 HydrophobicContact CD1-CE1 3.74Å; L353-Y383 HydrophobicContact CD1-CE2 3.45Å; L353-Y383 VanDerWaalsContact CD1-CE2 3.45Å; L353-Y383 HydrophobicContact CD1-CG 4.18Å; L353-Y383 HydrophobicContact CD2-CD1 4.3Å; L353-Y383 HydrophobicContact CD2-CD2 4.01Å; L353-Y383 HydrophobicContact CD2-CE2 4.46Å; L353-Y383 HydrophobicContact CD2-CG 3.91Å; L353-Y383 HydrophobicContact CG-CD1 4.4Å; L353-Y383 HydrophobicContact CG-CD2 3.56Å; L353-Y383 HydrophobicContact CG-CE1 4.43Å; L353-Y383 HydrophobicContact CG-CE2 3.62Å; L353-Y383 HydrophobicContact CG-CG 3.96Å; L353-Y383 VanDerWaalsContact O-CE2 3.3Å; L353-Y383 WeakPolarHBondContact O-CE2 3.44Å; M354-Y383 HydrophobicContact SD-CD2 4.03Å; L379-Y383 WeakPolarHBondContact O-CB 3.34Å; L379-Y383 PolarHBondContact O-N 3.26Å; L380-Y383 PolarHBondContact O-N 3.1Å; Y381-Y383 VanDerWaalsContact C-N 3.29Å; Y381-Y383 PolarHBondContact O-N 3.42Å; Y383-Q385 VanDerWaalsContact C-N 3.32Å; Y383-Q385 PolarHBondContact O-N 3.34Å; Y383-H386 PolarHBondContact O-N 3.23Å; Y383-F387 AromaticContact CD2-CD2 3.39Å; Y383-F387 HydrophobicContact CD2-CD2 3.39Å; Y383-F387 AromaticContact CD2-CE2 3.63Å; Y383-F387 HydrophobicContact CD2-CE2 3.63Å; Y383-F387 AromaticContact CE2-CD2 3.5Å; Y383-F387 HydrophobicContact CE2-CD2 3.5Å; Y383-F387 VanDerWaalsContact CE2-CD2 3.5Å; Y383-F387 AromaticContact CE2-CE2 3.74Å; Y383-F387 HydrophobicContact CE2-CE2 3.74Å; Y383-F387 HydrophobicContact CE2-CG 4.38Å; Y383-F387 HydrophobicContact CG-CD2 4.26Å; Y383-F387 WeakPolarHBondContact O-CD2 3.42Å; Y383-F387 PolarHBondContact O-N 3.12Å; Y383-R393 HydrophobicContact CE1-CB 3.99Å; Y383-R393 HydrophobicContact CE2-CB 4.36Å; Y383-R393 WeakPolarHBondContact OH-CB 3.48Å; Y383-G394 PolarHBondContact OH-N 3.27Å; Y383-I396 HydrophobicContact CD1-CD1 4.42Å
384	R	89.9	Confident	87.7	Confident	45 Å²	45	55.7 Å²	55.7	17%	0.17	26%	0.263	C	S	.	.	H	α-helix	trans	-65.8	-33.1	178.9	-65.4	176.2	83.8	-135.2	13.7	113.1	D244 L380 Y381 F387 I396 S412	D244-R384 IonicContact OD2-CZ 2.69Å; D244-R384 IonicContact OD2-NE 3.9Å; D244-R384 PolarHBondContact OD2-NE 2.92Å; D244-R384 IonicContact OD2-NH2 3.36Å; D244-R384 PolarHBondContact OD2-NH2 2.97Å; D244-R384 VanDerWaalsContact OD2-NH2 3.09Å; L380-R384 WeakPolarHBondContact O-CG 3.47Å; L380-R384 PolarHBondContact O-N 3.36Å; Y381-R384 PolarHBondContact O-N 3.18Å; R384-F387 CarbonylContact O-C 3.5Å; R384-I396 HydrophobicContact CG-CD1 3.89Å; R384-S412 PolarHBondContact NH1-OG 2.87Å; R384-S412 PolarHBondContact NH2-O 2.84Å; R384-S412 VanDerWaalsContact NH2-O 3.13Å
385	Q	88.5	Confident	87.5	Confident	110 Å²	110	50.1 Å²	50.1	51%	0.514	24%	0.237	S	C	.	.	H	α-helix	trans	-74.2	-35.1	176.1	-68.4	-67.2	-6.2	0	0	112.9	Y381 R382 Y383 T388	Y381-Q385 HydrophobicContact CD1-CG 4.12Å; Y381-Q385 HydrophobicContact CE1-CG 3.73Å; Y381-Q385 HydrophobicContact CE2-CG 4.39Å; Y381-Q385 WeakPolarHBondContact O-CG 3.45Å; Y381-Q385 PolarHBondContact O-N 3.04Å; Y381-Q385 PolarHBondContact OH-NE2 2.94Å; Y381-Q385 VanDerWaalsContact OH-NE2 3.09Å; R382-Q385 PolarHBondContact O-N 3.42Å; Y383-Q385 VanDerWaalsContact C-N 3.32Å; Y383-Q385 PolarHBondContact O-N 3.34Å; Q385-T388 WeakPolarHBondContact O-CG2 3.22Å
386	H	88	Confident	87.4	Confident	105 Å²	105	45.8 Å²	45.8	49%	0.486	22%	0.217	S	C	.	.	H	α-helix	trans	-78.9	-29.5	178.2	-164.6	-74.6	0	0	0	112.6	H45 M354 R382 Y383	H45-H386 AromaticContact NE2-CE1 3.71Å; M354-H386 HydrophobicContact CE-CB 3.84Å; R382-H386 VanDerWaalsContact O-CB 3.31Å; R382-H386 WeakPolarHBondContact O-CB 3.46Å; R382-H386 PolarHBondContact O-N 3.31Å; Y383-H386 PolarHBondContact O-N 3.23Å
387	F	85	Confident	87.3	Confident	7 Å²	7	45.9 Å²	45.9	3%	0.031	22%	0.217	C	C	.	.			trans	-121.8	71.6	179.7	-52.4	-79.5	0	0	0	109.8	H45 M354 Q356 Y383 R384 R393	H45-F387 AromaticContact CE1-CD1 3.54Å; H45-F387 AromaticContact CE1-CE1 3.28Å; H45-F387 WeakPolarHBondContact CE1-CE1 3.41Å; H45-F387 AromaticContact ND1-CD1 3.89Å; H45-F387 AromaticContact ND1-CE1 3.6Å; M354-F387 HydrophobicContact CE-CE2 4.06Å; M354-F387 HydrophobicContact SD-CE2 4.4Å; Q356-F387 VanDerWaalsContact CD-CE1 3.41Å; Q356-F387 HydrophobicContact CG-CD1 3.8Å; Q356-F387 HydrophobicContact CG-CE1 3.27Å; Q356-F387 HydrophobicContact CG-CE2 4.47Å; Q356-F387 HydrophobicContact CG-CZ 3.68Å; Y383-F387 AromaticContact CD2-CD2 3.39Å; Y383-F387 HydrophobicContact CD2-CD2 3.39Å; Y383-F387 AromaticContact CD2-CE2 3.63Å; Y383-F387 HydrophobicContact CD2-CE2 3.63Å; Y383-F387 AromaticContact CE2-CD2 3.5Å; Y383-F387 HydrophobicContact CE2-CD2 3.5Å; Y383-F387 VanDerWaalsContact CE2-CD2 3.5Å; Y383-F387 AromaticContact CE2-CE2 3.74Å; Y383-F387 HydrophobicContact CE2-CE2 3.74Å; Y383-F387 HydrophobicContact CE2-CG 4.38Å; Y383-F387 HydrophobicContact CG-CD2 4.26Å; Y383-F387 WeakPolarHBondContact O-CD2 3.42Å; Y383-F387 PolarHBondContact O-N 3.12Å; R384-F387 CarbonylContact O-C 3.5Å; F387-R393 HydrophobicContact CB-CB 3.7Å; F387-R393 HydrophobicContact CB-CG 3.82Å; F387-R393 HydrophobicContact CG-CB 4.31Å; F387-R393 VanDerWaalsContact O-CD 3.22Å; F387-R393 WeakPolarHBondContact O-CD 3.23Å; F387-R393 PolarHBondContact O-NE 3Å
388	T	82.5	Confident	87.3	Confident	107 Å²	107	44.9 Å²	44.9	66%	0.656	21%	0.21	S	C	*	.			trans	-66.1	-38.6	-177.8	53.8	0	0	0	0	112.7	Q385 Q390	Q385-T388 WeakPolarHBondContact O-CG2 3.22Å; T388-Q390 PolarHBondContact O-N 3.07Å
389	N	79.8	Confident	87.3	Confident	82 Å²	82	41.4 Å²	41.4	44%	0.439	20%	0.195	S	C	.	.	S	Bend	trans	-69.8	112.7	170.6	-178.2	10.8	0	0	0	110	A391 N392	N389-A391 VanDerWaalsContact C-N 3.27Å; N389-A391 PolarHBondContact O-N 3.46Å; N389-A391 WeakPolarHBondContact OD1-CB 3.21Å; N389-A391 PolarHBondContact OD1-N 3.17Å; N389-N392 HydrophobicContact CB-CB 4.43Å; N389-N392 PolarHBondContact ND2-ND2 3.5Å; N389-N392 VanDerWaalsContact ND2-ND2 3.18Å; N389-N392 PolarHBondContact ND2-OD1 3.35Å; N389-N392 WeakPolarHBondContact O-CB 3.15Å; N389-N392 PolarHBondContact O-N 3.28Å
390	Q	76.2	Confident	87.1	Confident	44 Å²	44	40.9 Å²	40.9	21%	0.206	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-67.3	-27.5	-176.5	-58.1	-175.2	11	0	0	112.9	Q243 T388 N392 R393	Q243-Q390 VanDerWaalsContact CA-OE1 3.24Å; Q243-Q390 VanDerWaalsContact CD-OE1 3.29Å; T388-Q390 PolarHBondContact O-N 3.07Å; Q390-N392 PolarHBondContact O-N 3.24Å; Q390-N392 VanDerWaalsContact O-N 3.15Å; Q390-R393 PolarHBondContact O-N 3.43Å; Q390-R393 VanDerWaalsContact O-O 3.14Å
391	A	72.2	Confident	86.8	Confident	27 Å²	27	46.8 Å²	46.8	22%	0.223	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-58.2	-27.9	172.8	0	0	0	0	0	111.6	L50 N389	L50-A391 WeakPolarHBondContact CB-O 3.35Å; L50-A391 VanDerWaalsContact CG-O 3.26Å; L50-A391 WeakPolarHBondContact CG-O 3.47Å; L50-A391 PolarHBondContact N-O 2.99Å; N389-A391 VanDerWaalsContact C-N 3.27Å; N389-A391 PolarHBondContact O-N 3.46Å; N389-A391 WeakPolarHBondContact OD1-CB 3.21Å; N389-A391 PolarHBondContact OD1-N 3.17Å
392	N	72.8	Confident	86.5	Confident	26 Å²	26	48.2 Å²	48.2	14%	0.139	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-95.7	7.1	-171.4	-60.4	0.3	0	0	0	113.3	D47 Q356 N389 Q390	D47-N392 VanDerWaalsContact OD1-CG 3.29Å; D47-N392 PolarHBondContact OD1-ND2 3.19Å; Q356-N392 PolarHBondContact NE2-O 2.8Å; N389-N392 HydrophobicContact CB-CB 4.43Å; N389-N392 PolarHBondContact ND2-ND2 3.5Å; N389-N392 VanDerWaalsContact ND2-ND2 3.18Å; N389-N392 PolarHBondContact ND2-OD1 3.35Å; N389-N392 WeakPolarHBondContact O-CB 3.15Å; N389-N392 PolarHBondContact O-N 3.28Å; Q390-N392 PolarHBondContact O-N 3.24Å; Q390-N392 VanDerWaalsContact O-N 3.15Å
393	R	84.3	Confident	86.3	Confident	11 Å²	11	48.5 Å²	48.5	4%	0.042	24%	0.24	C	C	.	.	S	Bend	trans	-150.1	152.1	-176.1	58.9	145.7	-178.4	102.6	-5.3	114.4	L50 D244 Y383 F387 Q390 R395	L50-R393 WeakPolarHBondContact CD1-O 3.46Å; D244-R393 IonicContact OD1-CZ 3.29Å; D244-R393 IonicContact OD1-NH1 2.73Å; D244-R393 PolarHBondContact OD1-NH1 3.38Å; D244-R393 IonicContact OD1-NH2 3.61Å; D244-R393 IonicContact OD2-CZ 3.86Å; D244-R393 IonicContact OD2-NH1 2.75Å; D244-R393 PolarHBondContact OD2-NH1 3.33Å; D244-R393 IonicContact OD2-NH2 3.71Å; D244-R393 PolarHBondContact OD2-NH2 3.3Å; Y383-R393 HydrophobicContact CE1-CB 3.99Å; Y383-R393 HydrophobicContact CE2-CB 4.36Å; Y383-R393 WeakPolarHBondContact OH-CB 3.48Å; F387-R393 HydrophobicContact CB-CB 3.7Å; F387-R393 HydrophobicContact CB-CG 3.82Å; F387-R393 HydrophobicContact CG-CB 4.31Å; F387-R393 VanDerWaalsContact O-CD 3.22Å; F387-R393 WeakPolarHBondContact O-CD 3.23Å; F387-R393 PolarHBondContact O-NE 3Å; Q390-R393 PolarHBondContact O-N 3.43Å; Q390-R393 VanDerWaalsContact O-O 3.14Å; R393-R395 PolarHBondContact O-N 3.1Å
394	G	84.6	Confident	86.1	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-55.6	134.9	178.7	0	0	0	0	0	112.4	C360 Y383	C360-G394 VanDerWaalsContact C-CA 3.43Å; C360-G394 VanDerWaalsContact O-CA 3.25Å; C360-G394 WeakPolarHBondContact O-CA 3.43Å; Y383-G394 PolarHBondContact OH-N 3.27Å
395	R	89	Confident	85.7	Confident	10 Å²	10	55.1 Å²	55.1	4%	0.038	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	132.6	179.3	-175.6	177.8	-173.2	-158.1	3.3	110.4	I52 S238 G241 D242 Q243 C245 C360 G361 I362 R393 I397	I52-R395 HydrophobicContact CD1-CB 4.48Å; S238-R395 VanDerWaalsContact O-CZ 3.28Å; S238-R395 PolarHBondContact O-NH1 3.33Å; S238-R395 PolarHBondContact O-NH2 2.84Å; G241-R395 PolarHBondContact O-NH1 3.13Å; G241-R395 VanDerWaalsContact O-NH1 3.13Å; G241-R395 PolarHBondContact O-NH2 2.91Å; D242-R395 WeakPolarHBondContact O-CD 3.11Å; D242-R395 WeakPolarHBondContact O-CG 3.49Å; D242-R395 PolarHBondContact O-NE 3.3Å; Q243-R395 VanDerWaalsContact O-CZ 3.22Å; Q243-R395 PolarHBondContact O-NE 3Å; Q243-R395 PolarHBondContact O-NH2 3.43Å; C245-R395 PolarHBondContact SG-NH2 2.88Å; C360-R395 PolarHBondContact O-N 3Å; C360-R395 VanDerWaalsContact O-N 3.07Å; G361-R395 WeakPolarHBondContact CA-O 3.35Å; I362-R395 PolarHBondContact N-O 3.08Å; R393-R395 PolarHBondContact O-N 3.1Å; R395-I397 HydrophobicContact CG-CD1 4.48Å; R395-I397 HydrophobicContact CG-CG1 4.07Å
396	I	93.5	Very high	84.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.1	177.2	-44.8	174.1	0	0	0	109	D244 C245 I362 I364 L380 Y383 R384 F413	D244-I396 VanDerWaalsContact CA-O 3.25Å; D244-I396 WeakPolarHBondContact CA-O 3.38Å; D244-I396 HydrophobicContact CB-CB 4.31Å; D244-I396 WeakPolarHBondContact CB-O 3.49Å; D244-I396 PolarHBondContact OD1-N 2.82Å; C245-I396 PolarHBondContact N-O 3.41Å; I362-I396 HydrophobicContact CB-CG2 4.37Å; I362-I396 HydrophobicContact CD1-CG1 4.43Å; I362-I396 WeakPolarHBondContact O-CA 3.45Å; I364-I396 HydrophobicContact CD1-CG2 3.93Å; L380-I396 HydrophobicContact CD2-CD1 4.24Å; Y383-I396 HydrophobicContact CD1-CD1 4.42Å; R384-I396 HydrophobicContact CG-CD1 3.89Å; I396-F413 HydrophobicContact CB-CE2 3.74Å; I396-F413 HydrophobicContact CB-CZ 4.03Å; I396-F413 HydrophobicContact CD1-CZ 4.04Å; I396-F413 HydrophobicContact CG2-CE2 3.61Å; I396-F413 HydrophobicContact CG2-CZ 3.96Å
397	I	94	Very high	84.4	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	118.7	-178.8	-55	-177.7	0	0	0	107.8	L247 L262 L266 I362 I363 I364 R395	L247-I397 HydrophobicContact CD1-CG2 3.86Å; L247-I397 HydrophobicContact CG-CG2 4.21Å; L262-I397 HydrophobicContact CB-CD1 4.31Å; L262-I397 HydrophobicContact CD1-CD1 4.11Å; L262-I397 HydrophobicContact CD1-CG2 3.99Å; L266-I397 HydrophobicContact CD1-CD1 4.21Å; I362-I397 PolarHBondContact O-N 3.3Å; I363-I397 CarbonylContact C-O 3.57Å; I363-I397 VanDerWaalsContact CA-O 3.27Å; I363-I397 WeakPolarHBondContact CA-O 3.49Å; I364-I397 PolarHBondContact N-O 3.33Å; R395-I397 HydrophobicContact CG-CD1 4.48Å; R395-I397 HydrophobicContact CG-CG1 4.07Å
398	C	94.3	Very high	84.5	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	156.6	-177.3	-46.3	0	0	0	0	111.2	C245 V246 L247 I364 V367 F410	C245-C398 PolarHBondContact O-N 3.44Å; V246-C398 CarbonylContact C-O 3.58Å; V246-C398 WeakPolarHBondContact CA-O 3.23Å; V246-C398 HydrophobicContact CG2-CB 4.27Å; L247-C398 PolarHBondContact N-O 2.79Å; I364-C398 HydrophobicContact CB-CB 4.14Å; I364-C398 CarbonylContact O-C 3.47Å; I364-C398 WeakPolarHBondContact O-CA 3.32Å; V367-C398 HydrophobicContact CG2-CB 3.39Å; C398-F410 VanDerWaalsContact SG-CD1 3.55Å; C398-F410 VanDerWaalsContact SG-CE1 3.52Å
399	F	93.4	Very high	84.8	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	138.9	170.1	-64	-92.4	0	0	0	111.9	L247 R255 I258 A259 I363 I364 H365 D366 V367	L247-F399 HydrophobicContact CB-CD1 3.79Å; L247-F399 HydrophobicContact CB-CE1 3.99Å; L247-F399 HydrophobicContact CD1-CD1 4.46Å; L247-F399 HydrophobicContact CD1-CE1 3.86Å; L247-F399 HydrophobicContact CD1-CZ 4.14Å; L247-F399 HydrophobicContact CG-CE1 4.5Å; L247-F399 WeakPolarHBondContact O-CA 3.11Å; R255-F399 HydrophobicContact CB-CD1 3.91Å; R255-F399 HydrophobicContact CB-CD2 4.48Å; R255-F399 HydrophobicContact CB-CE1 4.09Å; R255-F399 HydrophobicContact CB-CG 4.1Å; R255-F399 HydrophobicContact CB-CZ 4.45Å; R255-F399 HydrophobicContact CG-CB 4.11Å; R255-F399 HydrophobicContact CG-CD1 3.7Å; R255-F399 HydrophobicContact CG-CE1 4.29Å; R255-F399 HydrophobicContact CG-CG 3.97Å; R255-F399 WeakPolarHBondContact O-CZ 3.36Å; I258-F399 HydrophobicContact CB-CE1 3.94Å; I258-F399 HydrophobicContact CB-CZ 3.98Å; I258-F399 HydrophobicContact CG2-CE1 3.73Å; I258-F399 HydrophobicContact CG2-CZ 3.7Å; A259-F399 HydrophobicContact CB-CE2 3.84Å; A259-F399 HydrophobicContact CB-CZ 3.97Å; I363-F399 HydrophobicContact CG2-CD2 4.49Å; I363-F399 HydrophobicContact CG2-CE2 3.86Å; I364-F399 PolarHBondContact O-N 3.11Å; H365-F399 WeakPolarHBondContact O-CB 3.4Å; D366-F399 CarbonylContact C-O 3.6Å; D366-F399 WeakPolarHBondContact CA-O 3.37Å; V367-F399 WeakPolarHBondContact CG2-O 3.23Å; V367-F399 PolarHBondContact N-O 3.21Å
400	G	91.2	Very high	85.5	Confident	4 Å²	4	52.4 Å²	52.4	4%	0.041	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	168.8	175.6	0	0	0	0	0	111.9	L247 L249 R255	L247-G400 PolarHBondContact O-N 3.16Å; L249-G400 CarbonylContact C-O 3.49Å; L249-G400 PolarHBondContact N-O 3.37Å; R255-G400 PolarHBondContact NH2-O 3.42Å; R255-G400 VanDerWaalsContact NH2-O 3.09Å
401	Q	87.8	Confident	86.2	Confident	123 Å²	123	51.8 Å²	51.8	58%	0.575	27%	0.266	S	S	*	.	S	Bend	trans	-94.3	-66.7	162.5	-63.7	-176.7	-49.1	0	0	107.9
402	M	86.4	Confident	87	Confident	157 Å²	157	53.8 Å²	53.8	77%	0.773	28%	0.278	S	S	*	.	S	Bend	trans	-80.2	158.9	173.7	-65.5	-69.2	-77.6	0	0	112.1	L248	L248-M402 WeakPolarHBondContact CD2-O 3.35Å
403	K	87.3	Confident	88	Confident	158 Å²	158	53 Å²	53	69%	0.687	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-51.5	146.2	162.8	-77	-168.9	173.9	-172.3	0	110.3	L248	L248-K403 HydrophobicContact CD1-CG 3.76Å
404	V	87.8	Confident	88.3	Confident	18 Å²	18	55 Å²	55	11%	0.109	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-78.9	127.2	174.6	-168.3	0	0	0	0	108.9	V246 V367 S408 F410 Q415	V246-V404 HydrophobicContact CB-CG2 4.45Å; V246-V404 HydrophobicContact CG1-CG2 3.99Å; V246-V404 HydrophobicContact CG2-CG2 4.01Å; V367-V404 HydrophobicContact CG1-CG1 4.47Å; V367-V404 HydrophobicContact CG1-CG2 4.07Å; V404-S408 WeakPolarHBondContact CG1-OG 3.42Å; V404-F410 HydrophobicContact CG1-CB 4.03Å; V404-F410 HydrophobicContact CG2-CB 4.29Å; V404-Q415 VanDerWaalsContact N-OE1 3.08Å; V404-Q415 PolarHBondContact O-NE2 3.19Å
405	E	82.1	Confident	88.7	Confident	167 Å²	167	57.8 Å²	57.8	78%	0.78	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-70.1	158.1	173.7	-62.7	177.1	168.1	0	0	111.2	S408 S411	E405-S408 PolarHBondContact O-OG 3.49Å; E405-S411 WeakPolarHBondContact O-CB 3.5Å
406	D	69.7	Low	88.6	Confident	135 Å²	135	59.7 Å²	59.7	72%	0.722	31%	0.307	S	S	*	.	S	Bend	trans	-64.9	169.6	174.8	-67.7	-54.5	0	0	0	111.9
407	D	78.5	Confident	88.2	Confident	179 Å²	179	64.4 Å²	64.4	96%	0.957	36%	0.356	S	S	*	.	S	Bend	trans	69.7	20.7	-168.4	-62	-20.6	0	0	0	116.8
408	S	86.8	Confident	87.9	Confident	25 Å²	25	67.6 Å²	67.6	18%	0.175	37%	0.374	C	S	.	.	S	Bend	trans	-126.7	154.6	172.2	75.2	0	0	0	0	114.6	V404 E405 F410 S411	V404-S408 WeakPolarHBondContact CG1-OG 3.42Å; E405-S408 PolarHBondContact O-OG 3.49Å; S408-F410 PolarHBondContact O-N 3.23Å; S408-F410 VanDerWaalsContact O-N 3.13Å; S408-S411 PolarHBondContact O-N 3.22Å; S408-S411 VanDerWaalsContact O-N 3.14Å; S408-S411 PolarHBondContact O-OG 3.39Å; S408-S411 PolarHBondContact OG-N 2.95Å
409	V	90.1	Very high	87.5	Confident	15 Å²	15	71.2 Å²	71.2	9%	0.091	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-31.5	174.4	64	0	0	0	0	112.1	C377 Y381 S412 F413	C377-V409 HydrophobicContact CB-CG1 4.38Å; Y381-V409 HydrophobicContact CD2-CG2 4.21Å; V409-S412 PolarHBondContact O-OG 3.42Å; V409-F413 HydrophobicContact CG2-CE1 4.33Å; V409-F413 VanDerWaalsContact O-CD1 3.29Å; V409-F413 WeakPolarHBondContact O-CD1 3.46Å; V409-F413 WeakPolarHBondContact O-CE1 3.42Å
410	F	92.8	Very high	87.2	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-12.8	-177.7	-51.6	-67.9	0	0	0	114.3	V246 I364 V367 A370 L371 L380 C398 V404 S408 S412 F413	V246-F410 HydrophobicContact CG2-CB 4.33Å; I364-F410 HydrophobicContact CD1-CE1 3.87Å; I364-F410 HydrophobicContact CD1-CZ 4.1Å; V367-F410 HydrophobicContact CG1-CB 4.3Å; V367-F410 HydrophobicContact CG1-CD2 3.71Å; V367-F410 HydrophobicContact CG1-CE2 4.31Å; V367-F410 HydrophobicContact CG1-CG 4.15Å; A370-F410 HydrophobicContact CB-CE2 4.21Å; A370-F410 HydrophobicContact CB-CZ 4.15Å; L371-F410 HydrophobicContact CD2-CD2 3.82Å; L371-F410 HydrophobicContact CD2-CE2 4.01Å; L371-F410 HydrophobicContact CG-CD2 4.14Å; L371-F410 HydrophobicContact CG-CE2 4.2Å; L380-F410 HydrophobicContact CD1-CE1 3.86Å; L380-F410 HydrophobicContact CD1-CZ 3.84Å; C398-F410 VanDerWaalsContact SG-CD1 3.55Å; C398-F410 VanDerWaalsContact SG-CE1 3.52Å; V404-F410 HydrophobicContact CG1-CB 4.03Å; V404-F410 HydrophobicContact CG2-CB 4.29Å; S408-F410 PolarHBondContact O-N 3.23Å; S408-F410 VanDerWaalsContact O-N 3.13Å; F410-S412 VanDerWaalsContact C-N 3.25Å; F410-S412 PolarHBondContact O-N 3.47Å; F410-F413 HydrophobicContact CD1-CD2 4.23Å; F410-F413 HydrophobicContact CD1-CE1 4.2Å; F410-F413 AromaticContact CD1-CE2 3.72Å; F410-F413 HydrophobicContact CD1-CE2 3.72Å; F410-F413 AromaticContact CD1-CZ 3.71Å; F410-F413 HydrophobicContact CD1-CZ 3.71Å; F410-F413 HydrophobicContact CE1-CE2 4.26Å; F410-F413 HydrophobicContact CE1-CZ 4.16Å; F410-F413 WeakPolarHBondContact O-CB 3.44Å; F410-F413 PolarHBondContact O-N 3.19Å
411	S	90.9	Very high	87	Confident	32 Å²	32	79.3 Å²	79.3	22%	0.224	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-35.8	174.3	78.4	0	0	0	0	111	E405 S408 F413	E405-S411 WeakPolarHBondContact O-CB 3.5Å; S408-S411 PolarHBondContact O-N 3.22Å; S408-S411 VanDerWaalsContact O-N 3.14Å; S408-S411 PolarHBondContact O-OG 3.39Å; S408-S411 PolarHBondContact OG-N 2.95Å; S411-F413 PolarHBondContact O-N 3.06Å; S411-F413 VanDerWaalsContact O-N 3.1Å
412	S	90.1	Very high	86.9	Confident	69 Å²	69	76.6 Å²	76.6	48%	0.483	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	17.9	175.5	73.1	0	0	0	0	115.7	R384 V409 F410	R384-S412 PolarHBondContact NH1-OG 2.87Å; R384-S412 PolarHBondContact NH2-O 2.84Å; R384-S412 VanDerWaalsContact NH2-O 3.13Å; V409-S412 PolarHBondContact O-OG 3.42Å; F410-S412 VanDerWaalsContact C-N 3.25Å; F410-S412 PolarHBondContact O-N 3.47Å
413	F	92.5	Very high	86.9	Confident	10 Å²	10	71.2 Å²	71.2	4%	0.044	41%	0.406	C	S	.	.	S	Bend	trans	-106.9	153.8	176.5	-74.1	34	0	0	0	109.4	D244 V246 I396 V409 F410 S411 Q415	D244-F413 HydrophobicContact CB-CB 4.5Å; D244-F413 HydrophobicContact CB-CD1 4.15Å; D244-F413 HydrophobicContact CB-CD2 3.58Å; D244-F413 HydrophobicContact CB-CE1 4.28Å; D244-F413 HydrophobicContact CB-CE2 3.72Å; D244-F413 HydrophobicContact CB-CG 3.8Å; D244-F413 HydrophobicContact CB-CZ 4.07Å; V246-F413 HydrophobicContact CG2-CB 3.91Å; V246-F413 HydrophobicContact CG2-CD2 4.2Å; V246-F413 HydrophobicContact CG2-CG 4.41Å; I396-F413 HydrophobicContact CB-CE2 3.74Å; I396-F413 HydrophobicContact CB-CZ 4.03Å; I396-F413 HydrophobicContact CD1-CZ 4.04Å; I396-F413 HydrophobicContact CG2-CE2 3.61Å; I396-F413 HydrophobicContact CG2-CZ 3.96Å; V409-F413 HydrophobicContact CG2-CE1 4.33Å; V409-F413 VanDerWaalsContact O-CD1 3.29Å; V409-F413 WeakPolarHBondContact O-CD1 3.46Å; V409-F413 WeakPolarHBondContact O-CE1 3.42Å; F410-F413 HydrophobicContact CD1-CD2 4.23Å; F410-F413 HydrophobicContact CD1-CE1 4.2Å; F410-F413 AromaticContact CD1-CE2 3.72Å; F410-F413 HydrophobicContact CD1-CE2 3.72Å; F410-F413 AromaticContact CD1-CZ 3.71Å; F410-F413 HydrophobicContact CD1-CZ 3.71Å; F410-F413 HydrophobicContact CE1-CE2 4.26Å; F410-F413 HydrophobicContact CE1-CZ 4.16Å; F410-F413 WeakPolarHBondContact O-CB 3.44Å; F410-F413 PolarHBondContact O-N 3.19Å; S411-F413 PolarHBondContact O-N 3.06Å; S411-F413 VanDerWaalsContact O-N 3.1Å; F413-Q415 PolarHBondContact O-N 3.31Å; F413-Q415 VanDerWaalsContact O-N 3.15Å
414	T	91.6	Very high	86.9	Confident	53 Å²	53	65 Å²	65	33%	0.325	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	113.4	175.2	-51	0	0	0	0	110.4	D244 C245 V246 Y416	D244-T414 PolarHBondContact O-N 2.85Å; C245-T414 CarbonylContact C-O 3.54Å; C245-T414 WeakPolarHBondContact CA-O 3.32Å; C245-T414 WeakPolarHBondContact CB-O 3.31Å; V246-T414 PolarHBondContact N-O 2.71Å; T414-Y416 HydrophobicContact CG2-CD2 4.39Å; T414-Y416 HydrophobicContact CG2-CE1 3.93Å; T414-Y416 HydrophobicContact CG2-CE2 3.75Å; T414-Y416 VanDerWaalsContact CG2-CZ 3.49Å
415	Q	91.9	Very high	86.8	Confident	57 Å²	57	68.6 Å²	68.6	27%	0.266	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	124.3	-179.5	-52	-168.4	29.1	0	0	110.7	V246 V404 F413	V246-Q415 HydrophobicContact CB-CG 4.33Å; V246-Q415 WeakPolarHBondContact O-CA 3.43Å; V404-Q415 VanDerWaalsContact N-OE1 3.08Å; V404-Q415 PolarHBondContact O-NE2 3.19Å; F413-Q415 PolarHBondContact O-N 3.31Å; F413-Q415 VanDerWaalsContact O-N 3.15Å
416	Y	88.8	Confident	87.2	Confident	50 Å²	50	60.4 Å²	60.4	20%	0.196	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	143.1	177.1	-60.8	-74.5	0	0	0	111	N237 C245 V246 L247 L248 T414	N237-Y416 HydrophobicContact CB-CD1 3.83Å; N237-Y416 HydrophobicContact CB-CE1 4.12Å; N237-Y416 HydrophobicContact CB-CG 4.36Å; C245-Y416 HydrophobicContact CB-CD2 3.86Å; C245-Y416 HydrophobicContact CB-CE2 3.69Å; V246-Y416 PolarHBondContact O-N 2.86Å; L247-Y416 HydrophobicContact CD2-CD2 3.87Å; L247-Y416 HydrophobicContact CD2-CG 4.47Å; L248-Y416 WeakPolarHBondContact CB-O 3.09Å; L248-Y416 WeakPolarHBondContact CG-O 3.47Å; L248-Y416 PolarHBondContact N-O 3.04Å; T414-Y416 HydrophobicContact CG2-CD2 4.39Å; T414-Y416 HydrophobicContact CG2-CE1 3.93Å; T414-Y416 HydrophobicContact CG2-CE2 3.75Å; T414-Y416 VanDerWaalsContact CG2-CZ 3.49Å
417	G	83.4	Confident	88.8	Confident	100 Å²	100	53.6 Å²	53.6	100%	1.031	35%	0.345	S	S	*	.			trans	-151.7	0	172.4	0	0	0	0	0	111.2

Retrieved 417 of 417 residues in 963.5 ms (Link to these results)

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